| CAS Number | 722467-66-5 |
| Catalog Number | AG00FC34 |
| Chemical Name | 2-chloro-N-(3-formylphenyl)benzamide |
| IUPAC Name | 2-chloro-N-(3-formylphenyl)benzamide |
| InChI | InChI=1S/C14H10ClNO2/c15-13-7-2-1-6-12(13)14(18)16-11-5-3-4-10(8-11)9-17/h1-9H,(H,16,18) |
| InChI Key | GAKQNQAYVNFMJN-UHFFFAOYSA-N |
| MDL Number | MFCD03957576 |
| Molecular Formula | C14H10ClNO2 |
| Molecular Weight | 259.6877 |
| SMILES | O=C(NC1=CC=CC(C=O)=C1)C2=CC=CC=C2Cl |
| Synonyms | 2-chloro-N-(3-formylphenyl)benzamide,
2-Chloro-N-(3-formyl-phenyl)-benzamide,
722467-66-5,
AC1M6RMD,
AC1Q3HGG,
SCHEMBL18789745,
CTK7H9875,
ZINC3313198,
AKOS000115353,
MCULE-1188466530,
NE12640,
EN300-01141,
SR-01000038196,
J-509071,
SR-01000038196-1,
ZINC03313198,
CID2428990,
|
| Complexity | 308 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 259.04g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 259.689g/mol |
| Monoisotopic Mass | 259.04g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number