| CAS Number | 1048640-59-0 |
| Catalog Number | AG00J3T0 |
| Chemical Name | N-(Cyclohexylmethyl)-1-phenylethanamine hydrochloride |
| IUPAC Name | N-(cyclohexylmethyl)-1-phenylethanamine;hydrochloride |
| InChI | InChI=1S/C15H23N.ClH/c1-13(15-10-6-3-7-11-15)16-12-14-8-4-2-5-9-14;/h3,6-7,10-11,13-14,16H,2,4-5,8-9,12H2,1H3;1H |
| InChI Key | JQAGPIRACWTMRW-UHFFFAOYSA-N |
| MDL Number | MFCD03930948 |
| Molecular Formula | C15H24ClN |
| Molecular Weight | 253.8108 |
| SMILES | N(CC1CCCCC1)C(C)C1=CC=CC=C1.Cl |
| Synonyms | N-(Cyclohexylmethyl)-1-phenylethanamine hydrochloride,
1048640-59-0,
ARONIS004998,
KS-00003XN0,
ZX-CM016858,
MFCD03930948,
AKOS003745999,
ST45041779,
(cyclohexylmethyl)(phenylethyl)amine, chloride,
|
| Complexity | 178 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 253.16g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 253.814g/mol |
| Monoisotopic Mass | 253.16g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
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