| CAS Number | 67832-97-7 |
| Catalog Number | AG006IUK(AGN-PC-00OOMM) |
| Chemical Name | 2-Ethylbenzamide |
| IUPAC Name | 2-ethylbenzamide |
| InChI | InChI=1S/C9H11NO/c1-2-7-5-3-4-6-8(7)9(10)11/h3-6H,2H2,1H3,(H2,10,11) |
| InChI Key | GKTFLKJXZOYBRW-UHFFFAOYSA-N |
| MDL Number | MFCD18824517 |
| Molecular Formula | C9H11NO |
| Molecular Weight | 149.1897 |
| SMILES | C(C)C1=C(C(=O)N)C=CC=C1 |
| Synonyms | 2-Ethylbenzamide,
67832-97-7,
Benzamide, 2-ethyl-,
Athylbenzamid,
2-Ethyl-benzamide,
2-Ethylbenzenecarboxamide,
SCHEMBL162322,
CTK1J2865,
DTXSID70570826,
MFCD18824517,
ZINC34515121,
AKOS006339975,
NE53190,
N-Ethylbenzamide,
Benzamide,2-ethyl-,
Benzamide, 2-ethyl- (9CI),
614-17-5,
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| Complexity | 145 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 149.084g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 149.193g/mol |
| Monoisotopic Mass | 149.084g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 43.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number