| CAS Number | 33844-22-3 |
| Catalog Number | AG007IN8(AGN-PC-0JLLWS) |
| Chemical Name | 4-Methoxy-2-nitrobenzamide |
| EC Number | 251-698-0 |
| IUPAC Name | 4-methoxy-2-nitrobenzamide |
| InChI | InChI=1S/C8H8N2O4/c1-14-5-2-3-6(8(9)11)7(4-5)10(12)13/h2-4H,1H3,(H2,9,11) |
| InChI Key | QBDIKLOJLSJNTM-UHFFFAOYSA-N |
| MDL Number | MFCD02685088 |
| Molecular Formula | C8H8N2O4 |
| Molecular Weight | 196.1601 |
| SMILES | COc1ccc(c(c1)[N+](=O)[O-])C(=O)N |
| Synonyms | 4-methoxy-2-nitrobenzamide,
33844-22-3,
2-Nitro-p-anisamide,
4-methoxy-2-nitro-benzoic acid amide,
EINECS 251-698-0,
AC1Q1YDI,
4-methoxy-2-nitro-benzamide,
AC1L3N68,
SCHEMBL2839286,
CTK1C6309,
QBDIKLOJLSJNTM-UHFFFAOYSA-N,
ZINC4530378,
FCH846459,
MFCD02685088,
AKOS006277770,
ACM33844223,
AX8270782,
C8-H8-N2-O4,
AR-1G3069,
CID118558,
3496-88-6,
|
| Complexity | 238 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 196.048g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 196.162g/mol |
| Monoisotopic Mass | 196.048g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 98.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number