| CAS Number | 917383-03-0 |
| Catalog Number | AG00IGUS(AGN-PC-0CE07F) |
| Chemical Name | 4,4-difluoro-n-methoxy-n-methylcyclohexanecarboxamide |
| IUPAC Name | 4,4-difluoro-N-methoxy-N-methylcyclohexane-1-carboxamide |
| InChI | InChI=1S/C9H15F2NO2/c1-12(14-2)8(13)7-3-5-9(10,11)6-4-7/h7H,3-6H2,1-2H3 |
| InChI Key | QGDRGVWTVHQUOL-UHFFFAOYSA-N |
| MDL Number | MFCD24266530 |
| Molecular Formula | C9H15F2NO2 |
| Molecular Weight | 207.2177 |
| SMILES | CON(C(C1CCC(F)(F)CC1)=O)C |
| Synonyms | 917383-03-0,
4,4-Difluoro-N-methoxy-N-methylcyclohexanecarboxamide,
Cyclohexanecarboxamide, 4,4-difluoro-N-methoxy-N-methyl-,
4,4-Difluoro-N-methoxy-N-methylcyclohexane-1-carboxamide,
SCHEMBL2098790,
QGDRGVWTVHQUOL-UHFFFAOYSA-N,
MFCD24266530,
AKOS020914743,
ZINC118026637,
AS-43374,
4,4-difluoro-cyclohexanecarboxylic acid methoxy-methyl-amide,
|
| Complexity | 211 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.107g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.221g/mol |
| Monoisotopic Mass | 207.107g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number