| CAS Number | 167837-57-2 |
| Catalog Number | AG001XNP(AGN-PC-0N5936) |
| Chemical Name | Benzamide, 4-formyl-N-methyl- |
| IUPAC Name | 4-formyl-N-methylbenzamide |
| InChI | InChI=1S/C9H9NO2/c1-10-9(12)8-4-2-7(6-11)3-5-8/h2-6H,1H3,(H,10,12) |
| InChI Key | PUQLPZUXDZETND-UHFFFAOYSA-N |
| MDL Number | MFCD09759030 |
| Molecular Formula | C9H9NO2 |
| Molecular Weight | 163.1733 |
| SMILES | O=C(NC)C1=CC=C(C=O)C=C1 |
| Synonyms | 4-formyl-N-methylbenzamide,
167837-57-2,
4-formyl-N-methyl-benzamide,
4-(methylaminocarbonyl)-benzaldehyde,
N-Methyl-4-formylbenzamide,
AC1Q40KV,
SCHEMBL944150,
Benzamide,4-formyl-N-methyl-,
Benzamide, 4-formyl-N-methyl-,
CTK4D2784,
DTXSID10440650,
PUQLPZUXDZETND-UHFFFAOYSA-N,
MFCD09759030,
ZINC20281277,
AKOS006230639,
MCULE-3804916697,
NE23345,
EN300-30424,
CID10487212,
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| Complexity | 171 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 163.063g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 163.176g/mol |
| Monoisotopic Mass | 163.063g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number