| CAS Number | 854919-87-2 |
| Catalog Number | AG01AKZB |
| Chemical Name | 1-(Aminomethyl)-4,4-dimethylcyclohexan-1-ol |
| IUPAC Name | 1-(aminomethyl)-4,4-dimethylcyclohexan-1-ol |
| InChI | InChI=1S/C9H19NO/c1-8(2)3-5-9(11,7-10)6-4-8/h11H,3-7,10H2,1-2H3 |
| InChI Key | IGNIQYQEYLIVJD-UHFFFAOYSA-N |
| MDL Number | MFCD20184782 |
| Molecular Formula | C9H19NO |
| Molecular Weight | 157.2533 |
| SMILES | CC1(CCC(CN)(O)CC1)C |
| Synonyms | 1-(aminomethyl)-4,4-dimethylcyclohexan-1-ol,
854919-87-2,
SCHEMBL305744,
IGNIQYQEYLIVJD-UHFFFAOYSA-N,
ZINC70623270,
AKOS013722331,
1-(Aminomethyl)-4,4-dimethylcyclohexanol,
|
| Complexity | 133 |
| 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 | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 157.257g/mol |
| Monoisotopic Mass | 157.147g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number