| CAS Number | 17171-00-5 |
| Catalog Number | AG01BBMC(AGN-PC-0O4UVR) |
| Chemical Name | 1-(Bromomethyl)-1-fluorocyclohexane |
| IUPAC Name | 1-(bromomethyl)-1-fluorocyclohexane |
| InChI | InChI=1S/C7H12BrF/c8-6-7(9)4-2-1-3-5-7/h1-6H2 |
| InChI Key | PXTZBNRAAFANNT-UHFFFAOYSA-N |
| MDL Number | MFCD20623965 |
| Molecular Formula | C7H12BrF |
| Molecular Weight | 195.0726 |
| SMILES | FC1(CCCCC1)CBr |
| Synonyms | 1-(bromomethyl)-1-fluorocyclohexane,
17171-00-5,
SCHEMBL20504183,
ZINC220909958,
F1911-2873,
|
| Complexity | 86.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 194.011g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.075g/mol |
| Monoisotopic Mass | 194.011g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number