1H-indol-3-amine
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Basic information
- CAS
7250-19-3- Standard SMILES
Nc1c[nH]c2ccccc12- InChIKey
TXQAZWIBPGKHOX-UHFFFAOYSA-N- Molecular formula
- C8H8N2
- Average molar mass
- 132.16 g/mol
- Monoisotopic mass
- 132.06874826
Overview
1H-indol-3-amine is an indolamine.
Names & identifiers
- Preferred name
- 1H-indol-3-amine
- IUPAC
- 1H-indol-3-amine
- English name
- 1H-indol-3-amine
- Molecular formula
- C8H8N2
- Molecular weight
- 132.16
Names & synonyms
1H-indol-3-amine7250-19-31H-Indol-3-ylamine3-aminoindoleMFCD03848224ZINC5308741Hindol3amine3AMINOINDOLENc1c(nH)c2c1cccc21HINDOL3YLAMINE1HINDOLE3AMINE3AMINO1HINDOLE
Show more names
1263883-Amino-1H-indole1H-Indole-3-amineC1=CC=C2C(=C1)C(=CN2)N1H-Indole-3-amine, 95% (Custom work)
C01819SCHEMBL37668SCHEMBL650736SCHEMBL2014577SCHEMBL2953261CHEBI:28626DTXSID40282207NSC24933
Database identifiers
- CAS
7250-19-3- PubChem CID
- 230280
- DTXSID
DTXSID40282207- ChEBI
CHEBI:28626- EC Number
- 106-706-6
- Nikkaji
- J83.297I
Properties
Computed structural propertiesFilling in
- XLogP
- 1.9
- Topological polar surface area
- 41.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 124
Physicochemical properties
- Melting point
- 117 ℃ · 117℃
- Boiling point
- 354 · 354.0±15.0 °C(Predicted)
- Density
- 1.268 · 1.268±0.06 g/cm3(Predicted)
- pka
- 17.68 · 17.68±0.30(Predicted)
- Risk Statements
- 22 · 22-36
- Safety Statements
- 26 · 26
- HazardClass
- IRRITANT
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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P332+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- risk_code
- 22-36
- safety_code
- 26
- hazard_class
- IRRITANT
Chemistry & industry
Additional notes
DefinitionChEBI: 1H-indol-3-amine is an indolamine.
Related reactions
6 records
Compound notes
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