Basic information
- CAS
4665-04-7- Standard SMILES
CCOc1ccc(NC(C)=O)c(O)c1- InChIKey
CFLMLQJYYALAPD-UHFFFAOYSA-N- Molecular formula
- C10H13NO3
- Average molar mass
- 195.21 g/mol
- Monoisotopic mass
- 195.08954328
Names & identifiers
- Preferred name
- N-(4-Ethoxy-2-hydroxyphenyl)acetamide
- IUPAC
- N-(4-ethoxy-2-hydroxyphenyl)acetamide
- English name
- Fenacetinol
- Molecular formula
- C10H13NO3
- Molecular weight
- 195.22
Names & synonyms
O-HydroxyphenacetinAcetamide, N-(4-ethoxy-2-hydroxyphenyl)-2'-Hydroxy-p-acetophenetidide4'-Ethoxy-2'-hydroxyacetanilidep-Acetophenetidide, 2'-hydroxy-4665-04-7N-(4-Ethoxy-2-hydroxyphenyl)acetamideLPJ5TL089TDTXSID80196894RefChem:1091276DTXCID201193852-Hydroxyphenacetin
Show more names
TCMDC-125851NSC 116729NSC-116729EINECS 225-110-8BRN 2805180UNII-LPJ5TL089T2-hydroxy-4-ethoxyacetanilideCHEMBL528030
Database identifiers
- CAS
4665-04-7- PubChem CID
- 78396
- DTXSID
DTXSID80196894- ChEMBL
CHEMBL528030- UNII
- LPJ5TL089T
- Nikkaji
- J128.148H
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 196
Physicochemical properties
- Boiling point
- 399.1 · 399.1±32.0 °C(Predicted)
- Density
- 1.209 · 1.209±0.06 g/cm3(Predicted)
- pka
- 8.93 · 8.93±0.40(Predicted)
- FDA UNII
- 5 TL089T · LPJ5TL089T
Chemistry & industry
Suppliers1 total
陕西缔都医药化工有限公司+86-29-81139210 17389186172 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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