| CAS Number | 905811-04-3 |
| Catalog Number | AG006O3C(AGN-PC-0WB3T8) |
| Chemical Name | N-(3-aminophenyl)-4-chlorobenzamide |
| IUPAC Name | N-(3-aminophenyl)-4-chlorobenzamide |
| InChI | InChI=1S/C13H11ClN2O/c14-10-6-4-9(5-7-10)13(17)16-12-3-1-2-11(15)8-12/h1-8H,15H2,(H,16,17) |
| InChI Key | RCPUMSGSCKNPRZ-UHFFFAOYSA-N |
| MDL Number | MFCD01027216 |
| Molecular Formula | C13H11ClN2O |
| Molecular Weight | 246.6922 |
| SMILES | C(=O)(C1C=CC(=CC=1)Cl)NC1C=CC=C(N[H])C=1 |
| Synonyms | N-(3-aminophenyl)-4-chlorobenzamide,
905811-04-3,
SCHEMBL1336220,
CTK5G8143,
DTXSID20586139,
CHEMBRDG-BB 4024637,
ZINC9264608,
2780AF,
MFCD01027216,
STK256829,
AKOS000131618,
MCULE-6591597312,
RTR-048625,
AJ-59470,
TR-048625,
ST51039284,
N-(3-aminophenyl)(4-chlorophenyl)carboxamide,
W-7807,
C13H11ClN2O,
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| Complexity | 264 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 246.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 246.694g/mol |
| Monoisotopic Mass | 246.056g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number