| CAS Number | 1227808-08-3 |
| Catalog Number | AG009IDH(AGN-PC-0WNO7G) |
| Chemical Name | 1-(Aminomethyl)-4,4-difluorocyclohexanol Hydrochloride |
| IUPAC Name | 1-(aminomethyl)-4,4-difluorocyclohexan-1-ol;hydrochloride |
| InChI | InChI=1S/C7H13F2NO.ClH/c8-7(9)3-1-6(11,5-10)2-4-7;/h11H,1-5,10H2;1H |
| InChI Key | KYDIXHKOPOMUPZ-UHFFFAOYSA-N |
| MDL Number | MFCD28168089 |
| Molecular Formula | C7H14ClF2NO |
| Molecular Weight | 201.642 |
| SMILES | C1(CCC(CC1)(CN)O)(F)F.Cl |
| Synonyms | 1-(Aminomethyl)-4,4-difluorocyclohexanol hydrochloride,
1227808-08-3,
SCHEMBL15514311,
KYDIXHKOPOMUPZ-UHFFFAOYSA-N,
MFCD28168089,
AKOS027426171,
1-Aminomethyl-4,4-difluoro-cyclohexanol hydrochloride,
1227808-42-5,
|
| Complexity | 139 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 201.073g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 201.642g/mol |
| Monoisotopic Mass | 201.073g/mol |
| Rotatable Bond Count | 1 |
| 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