N-[1-(Hydroxymethyl)cyclohexyl]ethanimidic acid
Basic information
- CAS
53104-35-1- Standard SMILES
CC(=O)NC1(CO)CCCCC1- InChIKey
QLWVSWGZMRBRHR-UHFFFAOYSA-N- Molecular formula
- C9H17NO2
- Average molar mass
- 171.24 g/mol
- Monoisotopic mass
- 171.12592879
Names & identifiers
- Preferred name
- N-[1-(Hydroxymethyl)cyclohexyl]ethanimidic acid
- IUPAC
- N-[1-(hydroxymethyl)cyclohexyl]acetamide
Names & synonyms
53104-35-1NSC145088N-[1-(Hydroxymethyl)cyclohexyl]ethanimidic acidDTXSID50967639AKOS011811918NSC-145088
Database identifiers
- CAS
53104-35-1- PubChem CID
- 286598
- DTXSID
DTXSID50967639
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 49.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 162
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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