| CAS Number | 1048649-07-5 |
| Catalog Number | AG009MYP(AGN-PC-0WB7HC) |
| Chemical Name | [2-(1-cyclohexen-1-yl)ethyl](2-methylbenzyl)amine hydrochloride |
| IUPAC Name | 2-(cyclohexen-1-yl)-N-[(2-methylphenyl)methyl]ethanamine;hydrochloride |
| InChI | InChI=1S/C16H23N.ClH/c1-14-7-5-6-10-16(14)13-17-12-11-15-8-3-2-4-9-15;/h5-8,10,17H,2-4,9,11-13H2,1H3;1H |
| InChI Key | QRBWKGKNIFFPNH-UHFFFAOYSA-N |
| MDL Number | MFCD03930965 |
| Molecular Formula | C16H24ClN |
| Molecular Weight | 265.8215 |
| SMILES | C1(CCCCC=1)CCNCC1C=CC=CC=1C.Cl |
| Synonyms | 2-(1-CYCLOHEXEN-1-YL)-N-(2-METHYLBENZYL)-1-ETHANAMINE HYDROCHLORIDE,
1048649-07-5,
[2-(1-cyclohexen-1-yl)ethyl](2-methylbenzyl)amine hydrochloride,
2-(Cyclohex-1-en-1-yl)-N-(2-methylbenzyl)ethanamine hydrochloride,
ARONIS005067,
CTK6C2077,
KS-00003XOX,
BBB/358,
ZX-AS003593,
ZX-CM016863,
8052AC,
MFCD03930965,
SBB005744,
AKOS003746670,
TR-048123,
(2-cyclohex-1-enylethyl)[(2-methylphenyl)methyl]amine, chloride,
[2-(cyclohex-1-en-1-yl)ethyl][(2-methylphenyl)methyl]amine hydrochloride,
C16H24ClN,
N/A,
356531-13-0,
|
| Complexity | 244 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 265.16g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 265.825g/mol |
| Monoisotopic Mass | 265.16g/mol |
| Rotatable Bond Count | 5 |
| 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