| CAS Number | 40023-04-9 |
| Catalog Number | AG00761B(AGN-PC-0O9XWJ) |
| Chemical Name | 2-chloro-N-methyl-N-(1-phenylethyl)acetamide |
| IUPAC Name | 2-chloro-N-methyl-N-(1-phenylethyl)acetamide |
| InChI | InChI=1S/C11H14ClNO/c1-9(13(2)11(14)8-12)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3 |
| InChI Key | QBURJKXCINMVEV-UHFFFAOYSA-N |
| MDL Number | MFCD06655341 |
| Molecular Formula | C11H14ClNO |
| Molecular Weight | 211.6880 |
| SMILES | CC(C1=CC=CC=C1)N(C(CCl)=O)C |
| Synonyms | 2-chloro-N-methyl-N-(1-phenylethyl)acetamide,
40023-04-9,
AC1NLPWP,
AC1Q2B4H,
CTK4I2283,
DTXSID50406977,
AKOS008039527,
MCULE-4034005547,
NE42398,
EN300-12552,
ZINC04205434,
CID4961965,
2-CHLORO-N-METHYL-N- ACETAMIDE,
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| Complexity | 190 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 211.076g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.689g/mol |
| Monoisotopic Mass | 211.076g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 20.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number