14846-47-0 (3,5-二氨基-1,2,4-三氮唑,N-Octylamine hydrobromide)

CAS号:
14846-47-0
中文名称:
3,5-二氨基-1,2,4-三氮唑
英文名称:
N-Octylamine hydrobromide
安全信息:
分子式:
C8H20BrN
分子量:
210.155101776123

3,5-二氨基-1,2,4-三氮唑(14846-47-0)名称与标识符

名称

中文别名:
正辛胺氢溴酸盐;3,5-二氨基-1,2,4-三氮唑;正辛基溴化铵;
英文别名:
1-Octanamine, hydrobromide;n-Octylamine Hydrobromide;octan-1-amine,hydrobromide;(n-C8H17NH3)Br;n-Octylamin-hydrobromid;n-Octylammoniumbromid;octylammonium bromide;OABr;n-Octylammonium Bromide;Octylammonium bromide.;n-Octylamine hydrobromide,99%;octan-1-amine hydrobromide;Octan-1-amine--hydrogen bromide (1/1);O0442;octan-1-amine;hydrobromide;14846-47-0;DTXSID60698129;CS-0196434;n-Octylamine Hydrobromide, >/=98%;N-OCTYLAMINEHYDROBROMIDE;D91873;FT-0637147;AS-60939;1-Octanamine, hydrobromide (1:1);AKOS037645472;MFCD00044802;DB-042937;Octylamine Hydrobromide;835-405-9;

标识符

MDL:
MFCD00044802
InChIKey:
GIDDQKKGAYONOU-UHFFFAOYSA-N
Inchi:
1S/C8H19N.BrH/c1-2-3-4-5-6-7-8-9;/h2-9H2,1H3;1H
SMILES:
Br.NCCCCCCCC

3,5-二氨基-1,2,4-三氮唑(14846-47-0)物化性质

实验特性

  • LogP : 3.96400
  • PSA : 26.02000
  • 熔点 : 208°C(lit.)
  • 颜色与性状 : 无可用
  • 溶解性 : 无可用

计算特性

  • 精确分子量 : 209.07800
  • 氢键供体数量 : 2
  • 氢键受体数量 : 1
  • 可旋转化学键数量 : 6
  • 同位素质量 : 209.07791g/mol
  • 重原子数量 : 10
  • 复杂度 : 43.8
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 不确定原子立构中心数量 : 0
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 2
  • 疏水参数计算参考值(XlogP) : 无
  • 互变异构体数量 : 无
  • 表面电荷 : 0
  • 拓扑分子极性表面积 : 26

3,5-二氨基-1,2,4-三氮唑(14846-47-0)国际标准相关数据

EINECS:

3,5-二氨基-1,2,4-三氮唑(14846-47-0)推荐厂家 更多厂家(23)

3,5-二氨基-1,2,4-三氮唑(14846-47-0)参考资料

Reaxys RN:
3956185
Beilstein:
N159690
PubChem CID:

3,5-二氨基-1,2,4-三氮唑(14846-47-0) MSDS

基础信息

Name:n-Octylamine hydrobromide 99% Material Safety Data Sheet
Synonym:
CAS:14846-47-0
Section 1 - Chemical Product ? MSDS Name:n-Octylamine hydrobromide 99% Material Safety Data Sheet
Synonym:

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS#Chemical NamecontentEINECS#
14846-47-0N-Octylamine hydrobromide, 99%99%unlisted
Hazard Symbols: XI
Risk Phrases: 36/37/38

Section 3 - HAZARDS IDENTIFICATION
? EMERGENCY OVERVIEW
Irritating to eyes, respiratory system and skin.The toxicological properties of this material have not been fully investigated.
Potential Health Effects
Eye:
Causes eye irritation.
Skin:
Causes skin irritation.
Ingestion:
No information found. The toxicological properties of this substance have not been fully investigated.
Inhalation:
Causes respiratory tract irritation.
Chronic:
Not available.

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:
Flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes. Get medical aid if irritation develops or persists.
Ingestion:
Get medical aid. Wash mouth out with water.
Inhalation:
Remove from exposure and move to fresh air immediately. Get medical aid if cough or other symptoms appear.
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.
Extinguishing Media:
Use foam, dry chemical, or carbon dioxide.

Section 6 - ACCIDENTAL RELEASE MEASURES
? General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Vacuum or sweep up material and place into a suitable disposal container.

Section 7 - HANDLING and STORAGE
? Handling:
Avoid breathing dust, vapor, mist, or gas. Avoid contact with skin and eyes.
Storage:
Store in a cool, dry place. Store in a tightly closed container.

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.
Exposure Limits CAS# 14846-47-0: Personal Protective Equipment Eyes: Wear chemical splash goggles.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear a chemical apron.
Respirators:
A NIOSH/MSHA approved air purifying dust or mist respirator or European Standard EN 149.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES
?
Physical State: Solid
Color: white to light beige
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 203 - 206 deg C
Autoignition Temperature: Not available.
Flash Point: Not available.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density:
Molecular Formula: C8H19N.HBr
Molecular Weight: 210.16

Section 10 - STABILITY AND REACTIVITY
? Chemical Stability:
Not available.
Conditions to Avoid:
Not available.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Carbon monoxide, oxides of nitrogen, carbon dioxide, hydrogen bromide.
Hazardous Polymerization: Has not been reported.

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 14846-47-0 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
N-Octylamine hydrobromide, 99% - Not listed by ACGIH, IARC, or NTP.

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: XI
Risk Phrases:
R 36/37/38 Irritating to eyes, respiratory system
and skin.
Safety Phrases:
S 26 In case of contact with eyes, rinse immediately
with plenty of water and seek medical advice.
S 37/39 Wear suitable gloves and eye/face
protection.
WGK (Water Danger/Protection)
CAS# 14846-47-0: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 14846-47-0 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 14846-47-0 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A