| CAS Number | 1054552-66-7 |
| Catalog Number | AG00J3SL |
| Chemical Name | N-(3-methylbenzyl)cyclohexanamine hydrochloride |
| IUPAC Name | N-[(3-methylphenyl)methyl]cyclohexanamine;hydrochloride |
| InChI | InChI=1S/C14H21N.ClH/c1-12-6-5-7-13(10-12)11-15-14-8-3-2-4-9-14;/h5-7,10,14-15H,2-4,8-9,11H2,1H3;1H |
| InChI Key | FAHRAKVAWLWOQF-UHFFFAOYSA-N |
| MDL Number | MFCD03423465 |
| Molecular Formula | C14H22ClN |
| Molecular Weight | 239.7842 |
| SMILES | N(C1CCCCC1)CC1=CC=CC(C)=C1.Cl |
| Synonyms | N-(3-Methylbenzyl)cyclohexanamine hydrochloride,
1054552-66-7,
ZX-CM016826,
MFCD04104958,
AKOS003434204,
|
| Complexity | 172 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 239.144g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 239.787g/mol |
| Monoisotopic Mass | 239.144g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number