| CAS Number | 1065074-00-1 |
| Catalog Number | AG003SWO(AGN-PC-0WAEIL) |
| Chemical Name | N-Cyclohexyl 3-bromo-4-fluorobenzamide |
| IUPAC Name | 3-bromo-N-cyclohexyl-4-fluorobenzamide |
| InChI | InChI=1S/C13H15BrFNO/c14-11-8-9(6-7-12(11)15)13(17)16-10-4-2-1-3-5-10/h6-8,10H,1-5H2,(H,16,17) |
| InChI Key | MMIVSOVGVFUMDU-UHFFFAOYSA-N |
| MDL Number | MFCD11504867 |
| Molecular Formula | C13H15BrFNO |
| Molecular Weight | 300.1667 |
| SMILES | O=C(c1ccc(c(c1)Br)F)NC1CCCCC1 |
| Synonyms | N-CYCLOHEXYL 3-BROMO-4-FLUOROBENZAMIDE,
1065074-00-1,
N-Cyclohexyl3-bromo-4-fluorobenzamide,
ACMC-2098k4,
CTK4A4560,
DTXSID20674540,
ANW-15362,
MFCD11504867,
ZINC38537084,
AKOS015834194,
3-bromo-N-cyclohexyl-4-fluorobenzamide,
RTR-033956,
TR-033956,
Z6857,
A-4368,
I01-10819,
C13H15BrFNO,
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| Complexity | 268 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 299.032g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 300.171g/mol |
| Monoisotopic Mass | 299.032g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number