Basic information
- CAS
77971-45-0- Standard SMILES
Cl.Nc1ccccc1CCCO- InChIKey
XNNNZHYAVGWAFQ-UHFFFAOYSA-N- Molecular formula
- C9H14ClNO
- Average molar mass
- 187.66 g/mol
- Monoisotopic mass
- 187.0763918
Names & identifiers
- Preferred name
- 3-(2-Aminophenyl)propan-1-ol hydrochloride
- IUPAC
- 3-(2-aminophenyl)propan-1-ol;hydrochloride
- English name
- 3-(2-AMINOPHENYL)PROPAN-1-OL HYDROCHLORIDE
- Molecular formula
- C9H14ClNO
- Molecular weight
- 187.67
Names & synonyms
3-(2-Aminophenyl)propan-1-ol hydrochloride77971-45-03-(2-aminophenyl)propan-1-ol;hydrochlorideSCHEMBL99928543-(2-Aminophenyl)propan-1-ol HClMFCD31698477BS-46104F76348
Database identifiers
- CAS
77971-45-0- PubChem CID
- 67999995
Properties
Computed structural properties
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 106
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Suppliers3 total
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
无锡丽恒昇生物医药科技有限公司15250805028 15250805028 · [email protected]
北京蓝博特科技有限公司010-56330744 18310155299 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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