| CAS Number | 565172-41-0 |
| Catalog Number | AG00EFKH(AGN-PC-0WB27T) |
| Chemical Name | 2-Chloro-N-(2-chloro-5-nitrophenyl)propanamide |
| IUPAC Name | 2-chloro-N-(2-chloro-5-nitrophenyl)propanamide |
| InChI | InChI=1S/C9H8Cl2N2O3/c1-5(10)9(14)12-8-4-6(13(15)16)2-3-7(8)11/h2-5H,1H3,(H,12,14) |
| InChI Key | GSRRUZUPEBWJRP-UHFFFAOYSA-N |
| MDL Number | MFCD02662308 |
| Molecular Formula | C9H8Cl2N2O3 |
| Molecular Weight | 263.0774 |
| SMILES | CC(C(NC1=C(Cl)C=CC([N+]([O-])=O)=C1)=O)Cl |
| Synonyms | 2-chloro-N-(2-chloro-5-nitrophenyl)propanamide,
565172-41-0,
AC1Q2AVI,
AC1MW2T0,
C9H8Cl2N2O3,
CTK5I2814,
ALBB-002377,
KS-000029HY,
5717AE,
BBL037308,
MFCD02662308,
STK501984,
AKOS001057767,
AKOS016345715,
MCULE-7229706648,
MS-8311,
TR-052498,
R6037,
EN300-08348,
ZINC03252743,
CID3717513,
|
| Complexity | 282 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 261.991g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 263.074g/mol |
| Monoisotopic Mass | 261.991g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 74.9A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number