| CAS Number | 91249-23-9 |
| Catalog Number | AG01AH6M(AGN-PC-0WOT3H) |
| Chemical Name | 1-(aminomethyl)-4-tert-butylcyclohexan-1-ol hydrochloride |
| IUPAC Name | 1-(aminomethyl)-4-tert-butylcyclohexan-1-ol;hydrochloride |
| InChI | InChI=1S/C11H23NO.ClH/c1-10(2,3)9-4-6-11(13,8-12)7-5-9;/h9,13H,4-8,12H2,1-3H3;1H |
| InChI Key | WQUIOCMCKBHUQT-UHFFFAOYSA-N |
| MDL Number | MFCD18483223 |
| Molecular Formula | C11H24ClNO |
| Molecular Weight | 221.7674 |
| SMILES | Cl.CC(C1CCC(CN)(O)CC1)(C)C |
| Synonyms | 1-(aminomethyl)-4-tert-butylcyclohexan-1-ol hydrochloride,
91249-23-9,
AKOS008130516,
MCULE-8343146127,
NE37538,
EN300-73845,
Z1266854964,
|
| Complexity | 163 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 221.155g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 221.769g/mol |
| Monoisotopic Mass | 221.155g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number