Basic information
- CAS
1213035-38-1- Standard SMILES
CC[C@H](N)c1cccc2ncccc12- InChIKey
OLEAYSSHQXXINA-NSHDSACASA-N- Molecular formula
- C12H14N2
- Average molar mass
- 186.25 g/mol
- Monoisotopic mass
- 186.11569846
Names & identifiers
- Preferred name
- (1S)-1-quinolin-5-ylpropan-1-amine
- IUPAC
- (1S)-1-quinolin-5-ylpropan-1-amine
- English name
- (S)-1-(quinolin-5-yl)propan-1-amine
- Molecular formula
- C12H14N2
- Molecular weight
- 186.25
Names & synonyms
AKOS006290116(S)-1-(quinolin-5-yl)propan-1-amine5-Quinolinemethanamine, α-ethyl-, (αS)-
Database identifiers
- CAS
1213035-38-1- PubChem CID
- 55254294
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 38.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 181
Physicochemical properties
- Boiling point
- 325.5 · 325.5±17.0 °C(Predicted)
- Density
- 1.092 · 1.092±0.06 g/cm3(Predicted)
- pka
- 9.27 · 9.27±0.29(Predicted)
Chemistry & industry
Suppliers5 total
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
北京蓝博特科技有限公司010-56330744 18310155299 · [email protected]
重庆艾思摩尔科技有限公司023-86822659 18611316925 · [email protected]
Golden Pharma Co., Limited+86-18958062155 · [email protected]
北京珐默兹医药科技有限公司15811073878 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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