| CAS Number | 90942-40-8 |
| Catalog Number | AG01A99G |
| Chemical Name | N-[3-(chloromethyl)phenyl]acetamide |
| IUPAC Name | N-[3-(chloromethyl)phenyl]acetamide |
| InChI | InChI=1S/C9H10ClNO/c1-7(12)11-9-4-2-3-8(5-9)6-10/h2-5H,6H2,1H3,(H,11,12) |
| InChI Key | MOMMJJQBRPVSNG-UHFFFAOYSA-N |
| MDL Number | MFCD16547691 |
| Molecular Formula | C9H10ClNO |
| Molecular Weight | 183.6348 |
| SMILES | CC(=O)NC1=CC=CC(=C1)CCl |
| Synonyms | N-[3-(chloromethyl)phenyl]acetamide,
90942-40-8,
AC1Q1KNF,
3-acetylaminobenzylchloride,
SCHEMBL1742555,
MOMMJJQBRPVSNG-UHFFFAOYSA-N,
ZINC47844226,
AKOS017476557,
NE25946,
EN300-64514,
|
| Complexity | 161 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 183.045g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 183.635g/mol |
| Monoisotopic Mass | 183.045g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
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Certificate of Analysis
Lot Number