Basic information
- CAS
28945-26-8- Standard SMILES
CCCC[NH2+]CC1C(=O)C2(C)CCC1C2(C)C.[Cl-]- InChIKey
CQVRBVVDGQLAEQ-UHFFFAOYSA-N- Molecular formula
- C15H28ClNO
- Average molar mass
- 273.84 g/mol
- Monoisotopic mass
- 273.1859422
Names & identifiers
- Preferred name
- 2-Bornanone, 3-((butylamino)methyl)-, hydrochloride
- IUPAC
- butyl-[(4,7,7-trimethyl-3-oxo-2-bicyclo[2.2.1]heptanyl)methyl]azanium chloride
Names & synonyms
3-((Butylamino)methyl)-2-bornanone hydrochloride2-BORNANONE, 3-((BUTYLAMINO)METHYL)-, HYDROCHLORIDE28945-26-8RefChem:256691
Database identifiers
- CAS
28945-26-8- PubChem CID
- 34372
Properties
Computed structural properties
- Topological polar surface area
- 33.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 310
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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