| CAS Number | 37022-20-1 |
| Catalog Number | AG01DWDT |
| Chemical Name | 1-(aminomethyl)-3-methylcyclohexan-1-ol hydrochloride |
| IUPAC Name | 1-(aminomethyl)-3-methylcyclohexan-1-ol;hydrochloride |
| InChI | InChI=1S/C8H17NO.ClH/c1-7-3-2-4-8(10,5-7)6-9;/h7,10H,2-6,9H2,1H3;1H |
| InChI Key | WIPZKGJHIABQEA-UHFFFAOYSA-N |
| MDL Number | MFCD18072154 |
| Molecular Formula | C8H18ClNO |
| Molecular Weight | 179.6876 |
| SMILES | Cl.CC1CC(CN)(O)CCC1 |
| Synonyms | 1-(aminomethyl)-3-methylcyclohexanol hydrochloride,
37022-20-1,
SCHEMBL3665520,
cyclohexanol, 1-(aminomethyl)-3-methyl-, hydrochloride (1:1),
|
| Complexity | 116 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 179.108g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 179.688g/mol |
| Monoisotopic Mass | 179.108g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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