异丙基硫脲

  • 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
  • 上游产品
  • 下游产品

异丙基硫脲 基本信息

中文名称:
异丙基硫脲 
中文别名:
1-异丙基-2-硫脲;
异丙基硫脲;
N-异丙基硫脲 
英文名称:
Thiourea,N-(1-methylethyl)-
英文别名:
propan-2-ylthiourea;
Isopropylthioharnstoff;
i-propylthiourea;
N-Isopropylthiourea;
isopropylthiourea;
ISOPROPYLTHIOUREA;
USAF D-6;
Urea,1-isopropyl-2-thio;
1-iso-propyl-2-thiourea 
CAS No.:
1719-76-2
分 子 式:

C4H10N2S

分 子 量:
118.20
精确分子量:
118.05600
PSA:
70.14000
InChI:
InChI=1/C4H10N2S/c1-3(2)6-4(5)7/h3H,1-2H3,(H3,5,6,7)
危险品标志:

 

风险术语:

R22

安全术语:
S22;S36/37
分子结构式:
SDS:
查看

异丙基硫脲 物化性质

密度:
1.051 g/cm3
熔点:
169-170°C
沸点:
173.8ºC at 760 mmHg
闪点:
58.9ºC
折射率:
1.534
蒸汽压:
1.25mmHg at 25°C
存储条件/存储方法:

保持容器密封,储存在阴凉,干燥的地方 

稳定性相关:

常温常压下稳定,避免 氧化物接触

其它信息:

1.      性状:白色晶状粉末。

2.      密度(g/mL,25/4):未确定3.      相对蒸汽密度(g/mL,空气=1):未确定4.      熔点(ºC):169-1705.      沸点(ºC,常压):未确定6.      沸点(ºC,5.2kPa):未确定7.      折射率:未确定8.      闪点(ºC):未确定9.      比旋光度(º):未确定10.   自燃点或引燃温度(ºC):未确定11.   蒸气压(kPa,25ºC):未确定12.   饱和蒸气压(kPa,60ºC):未确定13.   燃烧热(KJ/mol):未确定14.   临界温度(ºC):未确定15.   临界压力(KPa):未确定16.   油水(辛醇/水)分配系数的对数值:未确定17.   爆炸上限(%,V/V):未确定18.   爆炸下限(%,V/V):未确定19.   溶解性:能溶于水。

异丙基硫脲 安全信息

包装等级:
III
海关代码:
2930909090
危险类别码:
R22
安全说明:
S22-S36/37/39
RTECS号:
YT6125000

异丙基硫脲 毒理性

CHEMICAL IDENTIFICATION

RTECS NUMBER :
YT6125000
CHEMICAL NAME :
Urea, 1-isopropyl-2-thio-
CAS REGISTRY NUMBER :
1719-76-2
BEILSTEIN REFERENCE NO. :
1743052
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C4-H10-N2-S
MOLECULAR WEIGHT :
118.22
WISWESSER LINE NOTATION :
SUYZMY1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: AD277-689
毒理学数据:

急性毒性:小鼠腹经LD50:100mg/kg;

生态数据:

对水是稍微有害的,不要让未稀释或大量的产品接触地下水,水道或者污水系统,若无政府许可,勿将材料排入周围环境

异丙基硫脲 MSDS

  Material Safety Data Sheet

Section 1. Identification of the substance
    Product Name:      N-Isopropylthiourea    
    Synonyms:

Section 2. Hazards identification
    Harmful by inhalation, in contact with skin, and if swallowed.
    H302:        Harmful if swallowed    
    P308+P313:        IF exposed or concerned: Get medical advice/attention    
    P330:        Rinse mouth    

Section 3. Composition/information on ingredients.
    Ingredient name:        N-Isopropylthiourea    
    CAS number:        1719-76-2    

Section 4. First aid measures
    Skin contact:        Immediately wash skin with copious amounts of water for at least 15 minutes while removing    
    contaminated clothing and shoes. If irritation persists, seek medical attention.
    Eye contact:        Immediately wash skin with copious amounts of water for at least 15 minutes. Assure adequate    
    flushing of the eyes by separating the eyelids with fingers. If irritation persists, seek medical
    attention.
    Inhalation:        Remove to fresh air. In severe cases or if symptoms persist, seek medical attention.    
    Ingestion:        Wash out mouth with copious amounts of water for at least 15 minutes. Seek medical attention.    

Section 5. Fire fighting measures
    In the event of a fire involving this material, alone or in combination with other materials, use dry
    powder or carbon dioxide extinguishers. Protective clothing and self-contained breathing apparatus
    should be worn.

Section 6. Accidental release measures
    Personal precautions: Wear suitable personal protective equipment which performs satisfactorily and meets local/state/national
    standards.
    Respiratory precaution:        Wear approved mask/respirator    
    Hand precaution:        Wear suitable gloves/gauntlets    
    Skin protection:        Wear suitable protective clothing    
    Eye protection:        Wear suitable eye protection    
    Methods for cleaning up: Mix with sand or similar inert absorbent material, sweep up and keep in a tightly closed container
    for disposal. See section 12.
    Environmental precautions: Do not allow material to enter drains or water courses.

Section 7. Handling and storage
    Handling:        This product should be handled only by, or under the close supervision of, those properly qualified    
    in the handling and use of potentially hazardous chemicals, who should take into account the fire,
    health and chemical hazard data given on this sheet.
    Storage:        Store in closed vessels.    

Section 8. Exposure Controls / Personal protection
    Engineering Controls: Use only in a chemical fume hood.
    Personal protective equipment: Wear laboratory clothing, chemical-resistant gloves and safety goggles.
    General hydiene measures: Wash thoroughly after handling. Wash contaminated clothing before reuse.

Section 9. Physical and chemical properties
    Appearance:        Not specified    
    Boiling point:        No data    
    Melting point:        No data    
    Flash point:        No data    
    Density:        No data    
    Molecular formula:        C4H10N2S    
    Molecular weight:        118.2    

Section 10. Stability and reactivity
    Conditions to avoid: Heat, flames and sparks.
    Materials to avoid: Oxidizing agents.
    Possible hazardous combustion products: Carbon monoxide, nitrogen oxides, sulfur oxides.

Section 11. Toxicological information
    No data.

Section 12. Ecological information
    No data.

Section 13. Disposal consideration
    Arrange disposal as special waste, by licensed disposal company, in consultation with local waste
    disposal authority, in accordance with national and regional regulations.

Section 14. Transportation information
    Non-harzardous for air and ground transportation.

Section 15. Regulatory information
    No chemicals in this material are subject to the reporting requirements of SARA Title III, Section
    302, or have known CAS numbers that exceed the threshold reporting levels established by SARA
    Title III, Section 313.


SECTION 16 - ADDITIONAL INFORMATION
N/A

异丙基硫脲 海关数据

中国海关编码:2930909090

概述:
2930909090. 其他有机硫化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 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
摘要/Summary:
2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

异丙基硫脲 分子结构与计算化学数据

分子结构数据

1、  摩尔折射率:34.95

2、  摩尔体积(m3/mol):112.4

3、  等张比容(90.2K):292.4

4、  表面张力(dyne/cm):45.6

5、  介电常数(F/m):无可用

6、  极化率10-24cm3):13.85

计算化学数据

1.疏水参数计算参考值(XlogP):0.4

2.氢键供体数量:2

3.氢键受体数量:1

4.可旋转化学键数量:1

5.互变异构体数量:3

6.拓扑分子极性表面积70.1

7.重原子数量:7

8.表面电荷:0

9.复杂度:70.1

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:1

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