N(omega)-甲基色胺; 3-(2-甲基氨基乙基)吲哚

  • 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
  • 表征图谱

N(omega)-甲基色胺; 3-(2-甲基氨基乙基)吲哚 基本信息

中文名称:
N(omega)-甲基色胺; 3-(2-甲基氨基乙基)吲哚 
中文别名:
N(omega)-甲基色胺;
3-(2-甲基氨基乙基)吲哚;
N-OMEGA-甲基色胺;
N-Ω-甲基色胺 
英文名称:
1H-Indole-3-ethanamine,N-methyl-
英文别名:
N-methyltryptamine;
2-(1H-Indol-3-yl)-N-methylethanamine;
3-(2-Methylaminoethyl)indole 
CAS No.:
61-49-4
分 子 式:
C11H14N2
分 子 量:
174.24
精确分子量:
174.11600
PSA:
27.82000
MDL:
MFCD00005657
EINECS:
200-507-9
InChI:
The Key: NCIKQJBVUNUXLW-UHFFFAOYSA-N
风险术语:
S24/25
安全术语:
S24/25
分子结构式:
SDS:
查看

N(omega)-甲基色胺; 3-(2-甲基氨基乙基)吲哚 物化性质

外观与性状:
白色至灰白色有光泽的结晶粉末或片
密度:
1.088 g/cm3
熔点:
87-89 °C(lit.)
沸点:
336.2ºCat 760 mmHg
闪点:
157.1ºC

N(omega)-甲基色胺; 3-(2-甲基氨基乙基)吲哚 安全信息

海关代码:
2933990090
WGK_Germany:
3
德国有关水污染物质的分类清单
安全说明:
S24/25
RTECS号:
NM0450000
安全标志:
S24/25:防止皮肤和眼睛接触。

N(omega)-甲基色胺; 3-(2-甲基氨基乙基)吲哚 毒理性

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NM0450000
CHEMICAL NAME :
Indole, 3-(2-(methylamino)ethyl)-
CAS REGISTRY NUMBER :
61-49-4
BEILSTEIN REFERENCE NO. :
0134134
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C11-H14-N2
MOLECULAR WEIGHT :
174.27

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 :
158 mg/kg
TOXIC EFFECTS :
Behavioral - excitement
REFERENCE :
JTEHD6 Journal of Toxicology and Environmental Health. (Hemisphere Pub., 1025 Vermont Ave., NW, Washington, DC 20005) V.1- 1975/76- Volume(issue)/page/year: 1,515,1976
毒理学数据:

1、急性毒性:小鼠腹腔LD50158mg/kg

N(omega)-甲基色胺; 3-(2-甲基氨基乙基)吲哚 MSDS

Name: n-Omega-methyltryptamine 99% Material Safety Data Sheet
Synonym: 3-(2-Methylaminoethyl)indole; 1H-Indole-3-ethanamine, N-methyl-; 3-(2-(Methylamino)ethyl)indole; Indole, 3-(2-(methylamino)ethyl)-; Methyltryptamine; N-Methyltryptamine; N-Monomethyltryptamin
CAS: 61-49-4
Section 1 - Chemical Product   MSDS Name:n-Omega-methyltryptamine 99% Material Safety Data Sheet
Synonym:3-(2-Methylaminoethyl)indole; 1H-Indole-3-ethanamine, N-methyl-; 3-(2-(Methylamino)ethyl)indole; Indole, 3-(2-(methylamino)ethyl)-; Methyltryptamine; N-Methyltryptamine; N-Monomethyltryptamin

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
61-49-4 N-omega-Methyltryptamine 99 200-507-9
Hazard Symbols: None Listed.
Risk Phrases: None Listed.

Section 3 - HAZARDS IDENTIFICATION
  EMERGENCY OVERVIEW
The toxicological properties of this material have not been fully investigated.
Potential Health Effects
Eye:
May cause eye irritation.
Skin:
May cause skin irritation.
Ingestion:
May cause irritation of the digestive tract. The toxicological properties of this substance have not been fully investigated.
Inhalation:
May cause respiratory tract irritation. The toxicological properties of this substance have not been fully investigated.
Chronic:
No information found.

Section 4 - FIRST AID MEASURES
  Eyes: Flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid.
Skin:
Get medical aid. Flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes. Wash clothing before reuse.
Ingestion:
Never give anything by mouth to an unconscious person. Get medical aid. Do NOT induce vomiting. If conscious and alert, rinse mouth and drink 2-4 cupfuls of milk or water.
Inhalation:
Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Get medical aid.
Notes to Physician:

Section 5 - FIRE FIGHTING MEASURES
  General Information:
As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion.
Extinguishing Media:
Use water spray, dry chemical, carbon dioxide, or appropriate foam.

Section 6 - ACCIDENTAL RELEASE MEASURES
  General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Sweep up, then place into a suitable container for disposal. Avoid generating dusty conditions. Provide ventilation.

Section 7 - HANDLING and STORAGE
  Handling:
Wash thoroughly after handling. Remove contaminated clothing and wash before reuse. Use with adequate ventilation. Minimize dust generation and accumulation. Avoid contact with eyes, skin, and clothing. Avoid ingestion and inhalation.
Storage:
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
  Engineering Controls:
Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower. Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 61-49-4: Personal Protective Equipment Eyes: Wear appropriate protective eyeglasses or chemical safety goggles as described by OSHA's eye and face protection regulations in 29 CFR 1910.133 or European Standard EN166.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
Respirators:
A respiratory protection program that meets OSHA's 29 CFR 1910.134 and ANSI Z88.2 requirements or European Standard EN 149 must be followed whenever workplace conditions warrant respirator use.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES
 
Physical State: Powder
Color: white
Odor: None reported.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 87.00 - 89.00 deg C
Autoignition Temperature: Not applicable.
Flash Point: Not applicable.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature: Not available.
Solubility in water: Not available.
Specific Gravity/Density: Not available.
Molecular Formula: C11H14N2
Molecular Weight: 174.24

Section 10 - STABILITY AND REACTIVITY
  Chemical Stability:
Stable under normal temperatures and pressures.
Conditions to Avoid:
Incompatible materials, strong oxidants.
Incompatibilities with Other Materials:
Oxidizing agents.
Hazardous Decomposition Products:
Nitrogen oxides, carbon monoxide, irritating and toxic fumes and gases, carbon dioxide, nitrogen.
Hazardous Polymerization: Will not occur.

Section 11 - TOXICOLOGICAL INFORMATION
  RTECS#:
CAS# 61-49-4: NM0450000 LD50/LC50:
Not available.
Carcinogenicity:
N-omega-Methyltryptamine - Not listed by ACGIH, IARC, or NTP.
Other:
See actual entry in RTECS for complete information.

Section 12 - ECOLOGICAL INFORMATION
 

Section 13 - DISPOSAL CONSIDERATIONS
  Dispose of in a manner consistent with federal, state, and local regulations.

Section 14 - TRANSPORT INFORMATION
 
IATA
Not regulated as a hazardous material.
IMO
Not regulated as a hazardous material.
RID/ADR
Not regulated as a hazardous material.

Section 15 - REGULATORY INFORMATION
 
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: Not available.
Risk Phrases:
Safety Phrases:
S 24/25 Avoid contact with skin and eyes.
WGK (Water Danger/Protection)
CAS# 61-49-4: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 61-49-4 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 61-49-4 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A

N(omega)-甲基色胺; 3-(2-甲基氨基乙基)吲哚 海关数据

中国海关编码:2933990090

概述:
2933990090. 其他仅含氮杂原子的杂环化合物. 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:20.0%
申报要素:
品名, 成分含量, 用途, 乌洛托品请注明外观, 6-己内酰胺请注明外观, 签约日期
摘要/Summary:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

N(omega)-甲基色胺; 3-(2-甲基氨基乙基)吲哚 分子结构与计算化学数据

分子结构数据

五、分子性质数据:

1、   摩尔折射率:56.30

2、   摩尔体积(m3/mol):160.0

3、   等张比容(90.2K):415.0

4、   表面张力(dyne/cm):45.2

5、   极化率10-24cm3):22.32

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:2

3.氢键受体数量:1

4.可旋转化学键数量:3

5.互变异构体数量:无

6.拓扑分子极性表面积27.8

7.重原子数量:13

8.表面电荷:0

9.复杂度:158

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

N(omega)-甲基色胺; 3-(2-甲基氨基乙基)吲哚 上游产品

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上海吉至生化科技有限公司

产品介绍:
产品名称:N-ω-甲基色胺 Cas号:61-49-4 纯度:99% 包装信息:1gea 价格:5,858.0元
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湖北恩星生物科技有限公司

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产品名称:N(omega)-甲基色胺 Cas号:61-49-4 纯度: 包装信息:500kg,400kg,300kg,200kg,100kg 价格:64.0元 - 100.0元
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