| CAS Number | 1094477-12-9 |
| Catalog Number | AG019UW0(AGN-PC-0WO61A) |
| Chemical Name | [1-(3-methylphenyl)cyclohexyl]methanamine |
| IUPAC Name | [1-(3-methylphenyl)cyclohexyl]methanamine |
| InChI | InChI=1S/C14H21N/c1-12-6-5-7-13(10-12)14(11-15)8-3-2-4-9-14/h5-7,10H,2-4,8-9,11,15H2,1H3 |
| InChI Key | MAQLUZGGBATJQX-UHFFFAOYSA-N |
| MDL Number | MFCD11642689 |
| Molecular Formula | C14H21N |
| Molecular Weight | 203.3232 |
| SMILES | CC1=CC(C2(CCCCC2)CN)=CC=C1 |
| Synonyms | [1-(3-methylphenyl)cyclohexyl]methanamine,
1094477-12-9,
(1-(m-Tolyl)cyclohexyl)methanamine,
AC1Q2GYZ,
SCHEMBL16691390,
CTK8F2320,
ZINC32628478,
AKOS009375942,
MCULE-4469018513,
NE18030,
EN300-42991,
Z1142870788,
|
| Complexity | 194 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 203.167g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 203.329g/mol |
| Monoisotopic Mass | 203.167g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number