| CAS Number | 42020-21-3 |
| Catalog Number | AG00BZB0 |
| Chemical Name | 2,5-dimethoxybenzamide |
| IUPAC Name | 2,5-dimethoxybenzamide |
| InChI | InChI=1S/C9H11NO3/c1-12-6-3-4-8(13-2)7(5-6)9(10)11/h3-5H,1-2H3,(H2,10,11) |
| InChI Key | KLYZILOJVQMYSK-UHFFFAOYSA-N |
| MDL Number | MFCD00017122 |
| Molecular Formula | C9H11NO3 |
| Molecular Weight | 181.1885 |
| NSC Number | 269901 |
| SMILES | c1c(ccc(c1C(=O)N)OC)OC |
| Synonyms | 2,5-DIMETHOXYBENZAMIDE,
42020-21-3,
Benzamide,2,5-dimethoxy-,
NSC269901,
CHEMBL458645,
SCHEMBL1086016,
CTK4I5577,
DTXSID70313391,
AC1L8311,
ZINC1560531,
AKOS005151309,
NSC-269901,
CJ-24513,
FT-0750010,
CID320829,
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| Complexity | 184 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 181.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 181.191g/mol |
| Monoisotopic Mass | 181.074g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 61.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number