Basic information
- CAS
55791-95-2- Standard SMILES
CCCCC(C)C(=O)Nc1cccc(O)c1- InChIKey
QWWDUZKRLMIROL-UHFFFAOYSA-N- Molecular formula
- C13H19NO2
- Average molar mass
- 221.29 g/mol
- Monoisotopic mass
- 221.14157885
Names & identifiers
- Preferred name
- Hexananilide, 3'-hydroxy-2-methyl-
- IUPAC
- N-(3-hydroxyphenyl)-2-methylhexanamide
- English name
- N-(3-Hydroxyphenyl)-2-methylhexanamide
- Molecular formula
- C13H19NO2
- Molecular weight
- 221.3
Names & synonyms
HEXANANILIDE, 3'-HYDROXY-2-METHYL-RefChem:10865713'-Hydroxy-2-methylhexananilide55791-95-2NSC222539Hexanamide, N-(3-hydroxyphenyl)-2-methyl-WLN: QR CMVY4&13-Hydroxy-2-methylhexananilideNSC 222539NSC-222539DS-014243N-(3-Hydroxyphenyl)-2-methylhexanamide
Database identifiers
- CAS
55791-95-2- PubChem CID
- 41578
- Nikkaji
- J73.685F
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 49.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 218
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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