| CAS Number | 53666-48-1 |
| Catalog Number | AG01A6ET(AGN-PC-0JMT19) |
| Chemical Name | N-(2-chloro-5-nitrophenyl)formamide |
| IUPAC Name | N-(2-chloro-5-nitrophenyl)formamide |
| InChI | InChI=1S/C7H5ClN2O3/c8-6-2-1-5(10(12)13)3-7(6)9-4-11/h1-4H,(H,9,11) |
| InChI Key | CRCYQFWNUVRVCO-UHFFFAOYSA-N |
| MDL Number | MFCD03649703 |
| Molecular Formula | C7H5ClN2O3 |
| Molecular Weight | 200.5792 |
| SMILES | ClC1=C(C=C(C=C1)[N+](=O)[O-])NC=O |
| Synonyms | N-(2-chloro-5-nitrophenyl)formamide,
53666-48-1,
Formamide, N-(2-chloro-5-nitrophenyl)-,
AC1L3MF6,
SCHEMBL5462968,
DTXSID90201908,
CRCYQFWNUVRVCO-UHFFFAOYSA-N,
ZINC4545675,
STK383098,
AKOS000439761,
MCULE-7706497909,
N-(2-chloro-5-nitrophenyl)carboxamide,
NE25583,
Formamide,N-(2-chloro-5-nitrophenyl)-,
ST51061239,
CID143077,
ZINC04545675,
|
| Complexity | 206 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 199.999g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 200.578g/mol |
| Monoisotopic Mass | 199.999g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 74.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number