| CAS Number | 326487-99-4 |
| Catalog Number | AG00CS2O(AGN-PC-0R7Z54) |
| Chemical Name | (1-Methoxy-4-methylcyclohexyl)methanamine |
| IUPAC Name | (1-methoxy-4-methylcyclohexyl)methanamine |
| InChI | InChI=1S/C9H19NO/c1-8-3-5-9(7-10,11-2)6-4-8/h8H,3-7,10H2,1-2H3 |
| InChI Key | NOUGKWPQTLNKSX-UHFFFAOYSA-N |
| MDL Number | MFCD16681074 |
| Molecular Formula | C9H19NO |
| Molecular Weight | 157.2533 |
| SMILES | COC1(CCC(C)CC1)CN |
| Synonyms | (1-methoxy-4-methylcyclohexyl)methanamine,
326487-99-4,
Cyclohexanemethanamine, 1-methoxy-4-methyl- (9CI),
CTK8I2115,
ZINC39089390,
AKOS011386835,
Z1945984181,
Cyclohexanemethanamine,1-methoxy-4-methyl-,
|
| Complexity | 117 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 157.147g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 157.257g/mol |
| Monoisotopic Mass | 157.147g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number