| CAS Number | 56961-87-6 |
| Catalog Number | AG00ELOB(AGN-PC-0JWMH2) |
| Chemical Name | 2-CHLORO-3-METHYLACETANILIDE |
| IUPAC Name | N-(2-chloro-3-methylphenyl)acetamide |
| InChI | InChI=1S/C9H10ClNO/c1-6-4-3-5-8(9(6)10)11-7(2)12/h3-5H,1-2H3,(H,11,12) |
| InChI Key | FDVJSCRXROMJQW-UHFFFAOYSA-N |
| MDL Number | MFCD01463354 |
| Molecular Formula | C9H10ClNO |
| Molecular Weight | 183.6348 |
| SMILES | CC(NC1=CC=CC(C)=C1Cl)=O |
| Synonyms | N-(2-chloro-3-methylphenyl)acetamide,
2-Chloro-3-methylacetanilide,
56961-87-6,
N-(2-chloro-3-methylphenyl)acetamide;N-(2-chloro-3-methylphenyl)acetamide,
AC1LGROF,
SCHEMBL13841433,
CTK6A1066,
ZINC345507,
MFCD01463354,
SBB090088,
AKOS006278685,
CS-0061206,
J3.631.100B,
AE-562/12222157,
CID825846,
ZINC00345507,
Acetamide, N-(2-chloro-3-methylphenyl)-,
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| Complexity | 172 |
| 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 | 1 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number