Basic information
- CAS
13283-96-0- Standard SMILES
C1CCC(NC2CCCCC2)CC1.CCCCCC(=O)O- InChIKey
KQRMBMCJQNMEDO-UHFFFAOYSA-N- Molecular formula
- C18H35NO2
- Average molar mass
- 297.5 g/mol
- Monoisotopic mass
- 297.26677936
Names & identifiers
- Preferred name
- Hexanoic acid, compd. with dicyclohexylamine (1:1)
- IUPAC
- N-cyclohexylcyclohexanamine;hexanoic acid
Names & synonyms
DichacDicyclohexylamine caproateDicyclohexylamine capronate13283-96-0DTXSID70157813RefChem:347729DTXCID7080304SCHEMBL11656156Hexanoic acid--N-cyclohexylcyclohexanamine (1/1)
Database identifiers
- CAS
13283-96-0- PubChem CID
- 25832
- DTXSID
DTXSID70157813
Properties
Computed structural properties
- Topological polar surface area
- 49.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 185
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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