盐酸依他苯酮

  • 基本信息
  • 物化性质
  • 安全信息
  • 毒理性
  • MSDS
  • 海关数据
  • 结构与计算化学

盐酸依他苯酮 基本信息

中文名称:
盐酸依他苯酮 
中文别名:
盐酸依他苯酮 
英文名称:
1-Propanone,1-[2-[2-(diethylamino)ethoxy]phenyl]-3-phenyl-, hydrochloride (9CI)
英文别名:
1-[2-[2-(diethylamino)ethoxy]phenyl]-3-phenylpropan-1-one,hydrochloride;
Corofenon;
1-[2-(2-Diaethylamino-aethoxy)-phenyl]-3-phenyl-propan-1-on,Hydrochlorid;
2'-[2-(diethylamino)ethoxy]-3-phenylpropiophenone hydrochloride;
Cardilicor;
etafenone hydrochloride;
1-[2-(2-diethylamino-ethoxy)-phenyl]-3-phenyl-propan-1-one,hydrochloride;
Dialicor;
Asamedel;
2'-(2-diethylaminoethoxy)-dihydrochalcone hydrochloride;
Coronabason;
Corodilan;
Etafenarin;
Hypochit;
Baxacor 
CAS No.:
2192-21-4
分 子 式:
C21H27NO2.ClH
分 子 量:
361.95
精确分子量:
361.18100
PSA:
29.54000
InChI:
The Key: BYWIEEUABBZFEE-UHFFFAOYSA-N
安全术语:
Poison by ingestion and intravenous routes. When heated to decomposition it emits very toxic fumes of NOx and HCl.
分子结构式:
SDS:
查看

盐酸依他苯酮 物化性质

密度:
1.043g/cm3
沸点:
464.2ºC at 760mmHg
闪点:
234.5ºC
蒸汽压:
8.53E-09mmHg at 25°C

盐酸依他苯酮 安全信息

海关代码:
2922509090

盐酸依他苯酮 毒理性

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UH0350000
CHEMICAL NAME :
Propiophenone, 2'-(2-(diethylamino)ethoxy)-3-phenyl-, hydrochloride
CAS REGISTRY NUMBER :
2192-21-4
LAST UPDATED :
199112
DATA ITEMS CITED :
9
MOLECULAR FORMULA :
C21-H27-N-O2.Cl-H
MOLECULAR WEIGHT :
361.95
WISWESSER LINE NOTATION :
2N2&2OR BV2R &GH

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
716 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 19,1664,1969
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
66 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: -,180,1990
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1900 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: -,180,1990
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
20800 ug/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 19,1664,1969
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
352 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,109,1982
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
90 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: -,180,1990
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
234 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 21,646,1987
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
28 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 23,966,1989
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Mammal - dog
DOSE/DURATION :
50 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 19,1664,1969

盐酸依他苯酮 MSDS

    Version 1.2
    Regulation (EC) No 1907/2006

    1 - Product and Company Information

    Product Name        2'-(2-DIETHYLAMINOETHOXY)-DIHYDROCHALCO&    

    2 - Hazards Identification

    3 - Composition/Information on Ingredients

    Product Name        CAS #        EC no        Annex I    
    Index Number
    2'-(2-DIETHYLAMINOETHOXY)-DIHYDROC 2192-21-4 218-587-9 None
    HALCONEHYDROCHLORIDE
    Formula        C21H27NO2.ClH    
    Molecular Weight 361,8900 AMU
    Synonyms        Asamedol * Baxacor * Corodilan * Dialicor *    
    Dialicor hydrochloride *
    1-(2-(2-(Diethylamino)ethoxy)phenyl)-3-phenyl-1-p
    ropanone hydrochloride *
    (O-beta-Diethylaminoethoxy)-phenyl propiophenone
    hydrochloride * Etafenone hydrochloride * Etafon
    hydrochloride * Hetaphenone * L.G. 11,457
    hydrochloride * Pagano-cor *
    beta-Phenyl-o-(diethylaminoethoxy)propiophenone
    hydrochloride * 1-Propanone,
    1-(2-(2-(diethylamino)ethoxy)phenyl)-3-phenyl-,
    hydrochloride (9CI) * Relicor * Relicor
    hydrochloride

    4 - First Aid Measures

    AFTER INHALATION
    If inhaled, remove to fresh air. If not breathing give
    artificial respiration. If breathing is difficult, give oxygen.
    AFTER INGESTION
    If swallowed, wash out mouth with water provided person is
    conscious. Call a physician.

    ALDRICH        www.molbase.com    
    5 - Fire Fighting Measures

    EXTINGUISHING MEDIA
    Suitable: Water spray. Carbon dioxide, dry chemical powder, or
    appropriate foam.
    SPECIAL RISKS
    Specific Hazard(s): Emits toxic fumes under fire conditions.
    SPECIAL PROTECTIVE EQUIPMENT FOR FIREFIGHTERS
    Wear self-contained breathing apparatus and protective clothing
    to prevent contact with skin and eyes.

    6 - Accidental Release Measures

    PERSONAL PRECAUTION PROCEDURES TO BE FOLLOWED IN CASE OF LEAK OR SPILL
    Evacuate area.
    PROCEDURE(S) OF PERSONAL PRECAUTION(S)
    Wear self-contained breathing apparatus, rubber boots, and heavy
    rubber gloves.
    METHODS FOR CLEANING UP
    Sweep up, place in a bag and hold for waste disposal. Avoid
    raising dust. Ventilate area and wash spill site after material
    pickup is complete.

    7 - Handling and Storage

    HANDLING
    Directions for Safe Handling: Do not breathe dust. Do not get in
    eyes, on skin, on clothing. Avoid prolonged or repeated exposure.
    STORAGE
    Conditions of Storage: Keep tightly closed. Store in a cool dry
    place.

    8 - Exposure Controls / Personal Protection

    ENGINEERING CONTROLS
    Safety shower and eye bath. Use only in a chemical fume hood.
    GENERAL HYGIENE MEASURES
    Wash thoroughly after handling.
    PERSONAL PROTECTIVE EQUIPMENT
    Special Protective Measures: Wear appropriate government approved
    respirator, chemical-resistant gloves, safety goggles, other
    protective clothing.

    9 - Physical and Chemical Properties

    pH N/A
    BP/BP Range        N/A    
    MP/MP Range        129,000. - 130,000 °    
    C.
    Flash Point        N/A    
    Flammability        N/A    
    Autoignition Temp        N/A    
    Oxidizing Properties N/A
    ALDRICH        www.molbase.com    
    Explosive Properties N/A
    Explosion Limits        N/A    
    Vapor Pressure        N/A    
    Partition Coefficient N/A
    Viscosity        N/A    
    Vapor Density        N/A    
    Saturated Vapor Conc. N/A
    Evaporation Rate        N/A    
    Bulk Density        N/A    
    Decomposition Temp.        N/A    
    Solvent Content        N/A    
    Water Content        N/A    
    Surface Tension        N/A    
    Conductivity        N/A    
    Miscellaneous Data        N/A    
    Solubility        N/A    

    10 - Stability and Reactivity

    STABILITY
    Materials to Avoid: Strong oxidizing agents.
    HAZARDOUS DECOMPOSITION PRODUCTS
    Hazardous Decomposition Products: Carbon monoxide, Carbon dioxide,
    Nitrogen oxides, Hydrogen chloride gas.

    11 - Toxicological Information

    RTECS NUMBER: UH0350000
    ACUTE TOXICITY
    LD50 LD50
    Oral Oral
    Rat Rat
    716,000000 mg/kg 716,000000 mg/kg
    Remarks: Behavioral:Convulsions or effect on seizure threshold.
    Behavioral:Convulsions or effect on seizure threshold.
    LD50 LD50
    Intraperitoneal Intraperitoneal
    Rat Rat
    66 MG/KG 66 MG/KG
    LD50 LD50
    Subcutaneous Subcutaneous
    Rat Rat
    1900 MG/KG 1900 MG/KG
    LD50 LD50
    Intravenous Intravenous
    Rat Rat
    20800 UG/KG 20800 UG/KG
    Remarks: Behavioral:Convulsions or effect on seizure threshold.
    Behavioral:Convulsions or effect on seizure threshold.
    LD50 LD50
    Oral Oral
    Mouse Mouse
    352,000000 mg/kg 352,000000 mg/kg
    ALDRICH        www.molbase.com    
    LD50 LD50
    Intraperitoneal Intraperitoneal
    Mouse Mouse
    90 MG/KG 90 MG/KG
    LD50 LD50
    Subcutaneous Subcutaneous
    Mouse Mouse
    234 MG/KG 234 MG/KG
    LD50 LD50
    Intravenous Intravenous
    Mouse Mouse
    28 MG/KG 28 MG/KG
    LD50 LD50
    Oral Oral
    Dog Dog
    50,000000 mg/kg 50,000000 mg/kg
    Remarks: Behavioral:Convulsions or effect on seizure threshold.
    Behavioral:Convulsions or effect on seizure threshold.
    SIGNS AND SYMPTOMS OF EXPOSURE
    To the best of our knowledge, the chemical, physical, and
    toxicological properties have not been thoroughly investigated.
    ROUTE OF EXPOSURE
    Inhalation: Material is irritating to mucous membranes and upper
    respiratory tract.
    Multiple Routes: May be fatal if inhaled, swallowed, or absorbed
    through skin. Causes eye and skin irritation.
    TARGET ORGAN INFORMATION
    Nerves. Heart.

    12 - Ecological Information

    No data available.

    13 - Disposal Considerations

    SUBSTANCE DISPOSAL
    Dissolve or mix the material with a combustible solvent and burn
    in a chemical incinerator equipped with an afterburner and
    scrubber. Observe all federal, state, and local environmental
    regulations.

    14 - Transport Information

    RID/ADR
    Non-hazardous for road transport.
    IMDG
    Non-hazardous for sea transport.
    IATA
    Non-hazardous for air transport.

    15 - Regulatory Information
    ALDRICH        www.molbase.com    

    COUNTRY SPECIFIC INFORMATION
    Germany
    WGK: 3
    Self-Classification

    16 - Other Information

    WARRANTY
    The above information is believed to be correct but does not
    purport to be all inclusive and shall be used only as a guide. The
    information in this document is based on the present state of our
    knowledge and is applicable to the product with regard to
    appropriate safety precautions. It does not represent any
    guarantee of the properties of the product. Inc.,
    shall not be held liable for any damage resulting from handling or
    from contact with the above product. See reverse side of invoice
    or packing slip for additional terms and conditions of sale.
    Copyright 2010 Co. License granted to make
    unlimitedpaper copies for internal use only.
    DISCLAIMER
    For R&D use only. Not for drug, household or other uses.
    ALDRICH        www.molbase.com    


SECTION 16 - ADDITIONAL INFORMATION
N/A

盐酸依他苯酮 海关数据

中国海关编码:2922509090

概述:
2922509090. 其他氨基醇酚、氨基酸酚及其他含氧基氨基化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:AB. 最惠国关税:6.5%. 普通关税:30.0%
申报要素:
品名, 成分含量, 用途, 乙醇胺及其盐应报明色度, 乙醇胺及其盐应报明包装
监管条件:
A.入境货物通关单B.出境货物通关单
检验检疫:
R.进口食品卫生监督检验S.出口食品卫生监督检验
摘要/Summary:
2922509090. other amino-alcohol-phenols, amino-acid-phenols and other amino-compounds with oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

盐酸依他苯酮 分子结构与计算化学数据

计算化学数据

1.疏水参数计算参考值(XlogP):无

2.氢键供体数量:1

3.氢键受体数量:3

4.可旋转化学键数量:10

5.互变异构体数量:2

6.拓扑分子极性表面积:29.5

7.重原子数量:25

8.表面电荷:0

9.复杂度:348

10.同位素原子数量:0

11.确定原子立构中心数量:0

12.不确定原子立构中心数量:0

13.确定化学键立构中心数量:0

14.不确定化学键立构中心数量:0

15.共价键单元数量:2

推荐供应商更多供应商>>

淄博航宇生物科技发展有限公司

产品介绍:
产品名称:盐酸依他苯酮 Cas号:2192-21-4 纯度:99% 包装信息:100kg 价格:洽谈
联系方式:
联系人:张经理 电话:15666366704 手机:15666366704
QQ: 2241752642
微信二维码
电话: 19906633110