Basic information
- CAS
41578-77-2- Standard SMILES
CC(=O)NCC(O)c1ccc([N+](=O)[O-])cc1- InChIKey
HYBXLDUPXUPJQQ-UHFFFAOYSA-N- Molecular formula
- C10H12N2O4
- Average molar mass
- 224.21 g/mol
- Monoisotopic mass
- 224.07970687
Names & identifiers
- Preferred name
- p-Nitrophenyl-2-acetamidoethanol
- IUPAC
- N-[2-hydroxy-2-(4-nitrophenyl)ethyl]acetamide
Names & synonyms
MLS000737180p-nitrophenyl-2-acetamidoethanolNSC89249CHEMBL1525981HMS2885D18NSC-8924941578-77-2SMR000528406
Database identifiers
- CAS
41578-77-2- PubChem CID
- 259366
- ChEMBL
CHEMBL1525981
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 95.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 256
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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