| CAS Number | 15787-48-1 |
| Catalog Number | AG01BEMM(AGN-PC-0O4IA1) |
| Chemical Name | 2-Cyclohexyl-4-methylpyridine |
| IUPAC Name | 2-cyclohexyl-4-methylpyridine |
| InChI | InChI=1S/C12H17N/c1-10-7-8-13-12(9-10)11-5-3-2-4-6-11/h7-9,11H,2-6H2,1H3 |
| InChI Key | AUUSSUJITFZKAX-UHFFFAOYSA-N |
| MDL Number | MFCD24539278 |
| Molecular Formula | C12H17N |
| Molecular Weight | 175.2701 |
| SMILES | CC1=CC(C2CCCCC2)=NC=C1 |
| Synonyms | 2-cyclohexyl-4-methylpyridine,
15787-48-1,
SCHEMBL17721316,
ZINC98095743,
AKOS033641353,
MCULE-8833644360,
NE17134,
Z1874954708,
|
| Complexity | 149 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 175.136g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 175.275g/mol |
| Monoisotopic Mass | 175.136g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number