Basic information
- Standard SMILES
C[C@@H](CO)c1ccc([N+](=O)[O-])cc1- InChIKey
JDZOOWNTZHWCNX-ZETCQYMHSA-N- Molecular formula
- C9H11NO3
- Average molar mass
- 181.19 g/mol
- Monoisotopic mass
- 181.07389321
Names & identifiers
- Preferred name
- (2R)-2-(4-nitrophenyl)propan-1-ol
- IUPAC
- (2R)-2-(4-nitrophenyl)propan-1-ol
Names & synonyms
(2R)-2-(4-nitrophenyl)propan-1-ol185130-37-4SCHEMBL6554242JDZOOWNTZHWCNX-ZETCQYMHSA-NEN300-6506529
Database identifiers
- PubChem CID
- 60078296
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 66.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 170
Related reactions
2 records
Compound notes
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