| CAS Number | 55794-85-9 |
| Catalog Number | AG01AMTP |
| Chemical Name | N-butyl-3-methylcyclohexan-1-amine |
| IUPAC Name | N-butyl-3-methylcyclohexan-1-amine |
| InChI | InChI=1S/C11H23N/c1-3-4-8-12-11-7-5-6-10(2)9-11/h10-12H,3-9H2,1-2H3 |
| InChI Key | KFJUEEKIJVBZSQ-UHFFFAOYSA-N |
| MDL Number | MFCD11142445 |
| Molecular Formula | C11H23N |
| Molecular Weight | 169.307 |
| SMILES | CCCCNC1CC(C)CCC1 |
| Synonyms | N-butyl-3-methylcyclohexan-1-amine,
55794-85-9,
AKOS000234630,
AKOS017274925,
Z90506808,
|
| Complexity | 112 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 169.183g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 169.312g/mol |
| Monoisotopic Mass | 169.183g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number