| CAS Number | 3318-15-8 |
| Catalog Number | AG00C8EP(AGN-PC-0WB47X) |
| Chemical Name | N-Benzyl-3-chloro-N-methylpropanamide |
| IUPAC Name | N-benzyl-3-chloro-N-methylpropanamide |
| InChI | InChI=1S/C11H14ClNO/c1-13(11(14)7-8-12)9-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3 |
| InChI Key | JAWIMEZRQVNCAC-UHFFFAOYSA-N |
| MDL Number | MFCD02286131 |
| Molecular Formula | C11H14ClNO |
| Molecular Weight | 211.6880 |
| SMILES | O=C(N(CC1=CC=CC=C1)C)CCCl |
| Synonyms | N-benzyl-3-chloro-N-methylpropanamide,
3318-15-8,
AC1MNV1J,
SCHEMBL6403389,
CTK6H7238,
DTXSID10391557,
ALBB-016623,
ZINC6178275,
MFCD02286131,
AKOS000152663,
AJ-55927,
FT-0684073,
W-9381,
propanamide, 3-chloro-N-methyl-N-(phenylmethyl)-,
I14-26960,
CID3333875,
N-benzyl-3-chloro-N-methyl-propanamide,
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| Complexity | 178 |
| 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 | 4 |
| Topological Polar Surface Area | 20.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number