Basic information
- Standard SMILES
CC(N)C1C[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc2C1O- InChIKey
AHNLEOCWKNTQQU-HONNSYHOSA-N- Molecular formula
- C18H19Cl2NO
- Average molar mass
- 336.3 g/mol
Names & identifiers
- Preferred name
- (4S)-2-(1-aminoethyl)-4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydronaphthalen-1-ol
- IUPAC
- (4S)-2-(1-aminoethyl)-4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydronaphthalen-1-ol
Names & synonyms
SCHEMBL815191AHNLEOCWKNTQQU-HONNSYHOSA-N(4S)-2-(1-aminoethyl)-4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydronaphthalen-1-ol
Database identifiers
- PubChem CID
- 58950758
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 380
Related reactions
2 records
Compound notes
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