| CAS Number | 827-66-7 |
| Catalog Number | AG004TFU(AGN-PC-0WAEEY) |
| Chemical Name | N-Acetyl 2-bromo-5-chloroaniline |
| IUPAC Name | N-(2-bromo-5-chlorophenyl)acetamide |
| InChI | InChI=1S/C8H7BrClNO/c1-5(12)11-8-4-6(10)2-3-7(8)9/h2-4H,1H3,(H,11,12) |
| InChI Key | VSYFNGALGIVDKP-UHFFFAOYSA-N |
| MDL Number | MFCD12026007 |
| Molecular Formula | C8H7BrClNO |
| Molecular Weight | 248.5043 |
| SMILES | CC(=O)Nc1cc(Cl)ccc1Br |
| Synonyms | N-(2-Bromo-5-chlorophenyl)acetamide,
827-66-7,
N-ACETYL 2-BROMO-5-CHLOROANILINE,
ACMC-209pqc,
SCHEMBL5042574,
CTK5F0056,
N-Acetyl2-bromo-5-chloroaniline,
DTXSID60618307,
ANW-37618,
MFCD12026007,
ZINC38537639,
AKOS015837991,
AJ-96188,
TR-025861,
V7895,
B-5520,
I14-25069,
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 | 2.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number