| CAS Number | 1365271-29-9 |
| Catalog Number | AG009WMF(AGN-PC-0WA4J6) |
| Chemical Name | 1-Cyclohexyl-6-fluoro-1,3-benzodiazole |
| IUPAC Name | 1-cyclohexyl-6-fluorobenzimidazole |
| InChI | InChI=1S/C13H15FN2/c14-10-6-7-12-13(8-10)16(9-15-12)11-4-2-1-3-5-11/h6-9,11H,1-5H2 |
| InChI Key | VNVCGBCUQSDFOA-UHFFFAOYSA-N |
| MDL Number | MFCD21609579 |
| Molecular Formula | C13H15FN2 |
| Molecular Weight | 218.2700 |
| SMILES | Fc1ccc2c(c1)n(cn2)C1CCCCC1 |
| Synonyms | 1-Cyclohexyl-6-fluoro-1,3-benzodiazole,
1365271-29-9,
ACMC-20aix4,
ANW-75446,
MFCD21609579,
ZINC85476357,
TC-164191,
V2539,
C13H15FN2,
|
| Complexity | 240 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 218.122g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 218.275g/mol |
| Monoisotopic Mass | 218.122g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 17.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number