Basic information
- CAS
1532-01-0- Standard SMILES
CC(C)C(=O)OC1CCC([NH+]2CCCCC2)CC1.[Cl-]- InChIKey
MMGAXWAZJLRZCM-UHFFFAOYSA-N- Molecular formula
- C15H28ClNO2
- Average molar mass
- 289.84 g/mol
- Monoisotopic mass
- 289.1808568
Names & identifiers
- Preferred name
- Isobutyric acid, 4-piperidinocyclohexyl ester, hydrochloride
- IUPAC
- (4-piperidin-1-ium-1-ylcyclohexyl) 2-methylpropanoate chloride
Names & synonyms
ISOBUTYRIC ACID, 4-PIPERIDINOCYCLOHEXYL ESTER, HYDROCHLORIDE1532-01-0RefChem:1087521Propanoic acid, 2-methyl-, 4-(1-piperidinyl)cyclohexyl ester, hydrochloride
Database identifiers
- CAS
1532-01-0- PubChem CID
- 15224
Properties
Computed structural properties
- Topological polar surface area
- 30.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 264
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…