| CAS Number | 893420-23-0 |
| Catalog Number | AG003Y57(AGN-PC-0WAEMQ) |
| Chemical Name | 4-Bromo-2-chloro-N-methylbenzamide |
| IUPAC Name | 4-bromo-2-chloro-N-methylbenzamide |
| InChI | InChI=1S/C8H7BrClNO/c1-11-8(12)6-3-2-5(9)4-7(6)10/h2-4H,1H3,(H,11,12) |
| InChI Key | UFLXVXIDMCMCCF-UHFFFAOYSA-N |
| MDL Number | MFCD19597086 |
| Molecular Formula | C8H7BrClNO |
| Molecular Weight | 248.5043 |
| SMILES | O=C(NC)C1=CC=C(Br)C=C1Cl |
| Synonyms | 4-Bromo-2-chloro-N-methylbenzamide,
893420-23-0,
N-Methyl 4-bromo-2-chlorobenzamide,
ACMC-209qzj,
SCHEMBL4517241,
CTK8B2596,
DTXSID80728997,
UFLXVXIDMCMCCF-UHFFFAOYSA-N,
ANW-39245,
MFCD19597086,
ZINC48190565,
4-Bromo-2-chloro-N-methyl-benzamide,
AKOS010135153,
MCULE-2617161135,
Benzamide, 4-bromo-2-chloro-N-methyl-,
AJ-110926,
TC-127990,
V8785,
B-8818,
C8H7BrClNO,
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| Complexity | 176 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 246.94g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 248.504g/mol |
| Monoisotopic Mass | 246.94g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number