Basic information
- CAS
21005-60-7- Standard SMILES
NCCc1ccc2[nH]ccc2c1- InChIKey
ALEWOQWOFUSKHR-UHFFFAOYSA-N- Molecular formula
- C10H12N2
- Average molar mass
- 160.22 g/mol
- Monoisotopic mass
- 160.10004838
Names & identifiers
- Preferred name
- 2-(1H-Indol-5-yl)ethan-1-amine
- IUPAC
- 2-(1H-indol-5-yl)ethanamine
- English name
- RARECHEM AN KA 0030
- Molecular formula
- C10H12N2
- Molecular weight
- 160.22
Names & synonyms
21005-60-72-(1H-Indol-5-yl)ethan-1-amineDTXSID00589401RefChem:249946DTXCID70540165848-914-62-(1H-Indol-5-yl)ethanamine1H-Indole-5-ethanamineMFCD08448752SCHEMBL1252146CHEMBL4554346SCHEMBL30937489
Show more names
AKOS VGU4009RARECHEM AN KA 0030[2-(1H-indol-5-yl)ethyl]amine
2-(1H-indol-5-yl)-ethylamineALEWOQWOFUSKHR-UHFFFAOYSA-NALBB-029971AKOS004122062FS-3687FI141405DB-345747CS-0308879
Database identifiers
- CAS
21005-60-7- PubChem CID
- 17221102
- DTXSID
DTXSID00589401- ChEMBL
CHEMBL4554346- EC Number
- 848-914-6
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 41.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 147
Physicochemical properties
- Boiling point
- 342.5 · 342.5±17.0 °C(Predicted)
- Density
- 1.157 · 1.157±0.06 g/cm3(Predicted)
- pka
- 17.12 · 17.12±0.30(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 318 · H318-H315-H302-H335
- Precautionary statements
- 280 · P280-P305+P351+P338-P310-P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H318-H315-H302-H335
- Precautionary statements
- P280-P305+P351+P338-P310-P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Suppliers16 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
宁波亿诺化学品有限公司86-574-27787657 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
斯芬克司药物研发（天津）股份有限公司022-66211289-843 13672102692 · [email protected]
金瓯生物医药（南京）有限公司13000000000 · [email protected]
武汉壹加壹生物科技有限公司027-027-16602739303 16602739303 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
成都康悦慧蓝医药技术有限公司028-81092800 17323275954 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
德州博腾精细化工有限公司[email protected]
ATK CHEMICAL COMPANY LIMITED+undefined-21-51877795 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
Related reactions
3 records
Compound notes
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