| CAS Number | 915921-70-9 |
| Catalog Number | AG00GTRK(AGN-PC-0WB552) |
| Chemical Name | 3-chloro-N-(4-methoxy-2-methylphenyl)propanamide |
| IUPAC Name | 3-chloro-N-(4-methoxy-2-methylphenyl)propanamide |
| InChI | InChI=1S/C11H14ClNO2/c1-8-7-9(15-2)3-4-10(8)13-11(14)5-6-12/h3-4,7H,5-6H2,1-2H3,(H,13,14) |
| InChI Key | RHRZNQDYJFZOBS-UHFFFAOYSA-N |
| MDL Number | MFCD08569900 |
| Molecular Formula | C11H14ClNO2 |
| Molecular Weight | 227.6874 |
| SMILES | N(C(=O)CCCl)C1=CC=C(C=C1C)OC |
| Synonyms | 3-chloro-N-(4-methoxy-2-methylphenyl)propanamide,
915921-70-9,
CHEMBRDG-BB 9071565,
SCHEMBL426569,
CTK5G9994,
DTXSID40589304,
RHRZNQDYJFZOBS-UHFFFAOYSA-N,
ALBB-003575,
3084AF,
BBL017774,
MFCD08569900,
STK482330,
ZINC13322631,
AKOS003398939,
MCULE-8567222241,
AJ-63626,
ST45135914,
Y-3965,
3-chloro-N-(4-methoxy-2-methylphenyl)propaneamide,
C11H14ClNO2,
|
| Complexity | 211 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.071g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.688g/mol |
| Monoisotopic Mass | 227.071g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number