2-Ethoxy-4-(hydroxymethyl)-6-nitrophenol
Basic information
- CAS
677310-20-2- Standard SMILES
CCOc1cc(CO)cc([N+](=O)[O-])c1O- InChIKey
ZOQLUAXOMCJMKI-UHFFFAOYSA-N- Molecular formula
- C9H11NO5
- Average molar mass
- 213.19 g/mol
- Monoisotopic mass
- 213.06372245
Names & identifiers
- Preferred name
- 2-Ethoxy-4-(hydroxymethyl)-6-nitrophenol
- IUPAC
- 2-ethoxy-4-(hydroxymethyl)-6-nitrophenol
- English name
- Benzenemethanol, 3-ethoxy-4-hydroxy-5-nitro- (9CI)
- Molecular formula
- C9H11NO5
- Molecular weight
- 213.19
Names & synonyms
2-ethoxy-4-(hydroxymethyl)-6-nitrophenol677310-20-23-ETHOXY-4-HYDROXY-5-NITRO-BENZENEMETHANOLDTXSID50358422DB-285434Benzenemethanol, 3-ethoxy-4-hydroxy-5-nitro-SR-01000266556SR-01000266556-1Benzenemethanol, 3-ethoxy-4-hydroxy-5-nitro- (9CI)
Database identifiers
- CAS
677310-20-2- PubChem CID
- 894167
- DTXSID
DTXSID50358422
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 95.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 217
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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