| CAS Number | 334709-06-7 |
| Catalog Number | AG00CMMY(AGN-PC-06KHD8) |
| Chemical Name | N-BENZYL-4-(CHLOROMETHYL)BENZAMIDE |
| IUPAC Name | N-benzyl-4-(chloromethyl)benzamide |
| InChI | InChI=1S/C15H14ClNO/c16-10-12-6-8-14(9-7-12)15(18)17-11-13-4-2-1-3-5-13/h1-9H,10-11H2,(H,17,18) |
| InChI Key | UOWAIXVFBHUXKT-UHFFFAOYSA-N |
| MDL Number | MFCD11544488 |
| Molecular Formula | C15H14ClNO |
| Molecular Weight | 259.7308 |
| SMILES | ClCc1ccc(cc1)C(=O)NCc1ccccc1 |
| Synonyms | n-benzyl-4-(chloromethyl)benzamide,
334709-06-7,
MFCD11544488,
ZINC37342909,
2-(7-methyl-1H-indol-1-yl)aceticacid,
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| Complexity | 255 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 259.076g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 259.733g/mol |
| Monoisotopic Mass | 259.076g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number