Phenol, 2-[(2S)-3-amino-2-hydroxypropoxy]-
Basic information
- CAS
437765-36-1- Standard SMILES
NC[C@H](O)COc1ccccc1O- InChIKey
BZVHVRVBYPQBCI-ZETCQYMHSA-N- Molecular formula
- C9H13NO3
- Average molar mass
- 183.2 g/mol
Names & identifiers
- Preferred name
- Phenol, 2-[(2S)-3-amino-2-hydroxypropoxy]-
- IUPAC
- 2-[(2S)-3-amino-2-hydroxypropoxy]phenol
- English name
- Phenol, 2-[(2S)-3-amino-2-hydroxypropoxy]- (9CI)
- Molecular formula
- C9H13NO3
- Molecular weight
- 183.2
Names & synonyms
437765-36-1DB-277404PHENOL, 2-[(2S)-3-AMINO-2-HYDROXYPROPOXY]-Phenol, 2-[(2S)-3-amino-2-hydroxypropoxy]- (9CI)
Database identifiers
- CAS
437765-36-1
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 75.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 143
Physicochemical properties
- Boiling point
- 401.2 · 401.2±35.0 °C(Predicted)
- Density
- 1.251 · 1.251±0.06 g/cm3(Predicted)
- pka
- 9.57 · 9.57±0.30(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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