| CAS Number | 1365272-24-7 |
| Catalog Number | AG00120P(AGN-PC-0J2C7T) |
| Chemical Name | 4-(2-Cyanophenyl)-N,N-dimethylbenzamide |
| IUPAC Name | 4-(2-cyanophenyl)-N,N-dimethylbenzamide |
| InChI | InChI=1S/C16H14N2O/c1-18(2)16(19)13-9-7-12(8-10-13)15-6-4-3-5-14(15)11-17/h3-10H,1-2H3 |
| InChI Key | HNEJRBSBVCTPJB-UHFFFAOYSA-N |
| MDL Number | MFCD21609617 |
| Molecular Formula | C16H14N2O |
| Molecular Weight | 250.2952 |
| SMILES | N#Cc1ccccc1c1ccc(cc1)C(=O)N(C)C |
| Synonyms | 4-(2-Cyanophenyl)-N,N-dimethylbenzamide,
1365272-24-7,
ACMC-209c7o,
CTK8B0531,
DTXSID70742884,
ANW-20098,
MFCD21609617,
ZINC85477063,
CJ-22414,
TC-108843,
B-8601,
2'-Cyano-N,N-dimethyl[1,1'-biphenyl]-4-carboxamide,
[1,1'-Biphenyl]-4-carboxamide, 2'-cyano-N,N-dimethyl-,
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| Complexity | 360 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 250.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 250.301g/mol |
| Monoisotopic Mass | 250.111g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 44.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number