| CAS Number | 1803801-74-2 |
| Catalog Number | AG00I027 |
| Chemical Name | 2,3-Dichloro-1-nitro-4-(trifluoromethyl)benzene |
| IUPAC Name | 2,3-dichloro-1-nitro-4-(trifluoromethyl)benzene |
| InChI | InChI=1S/C7H2Cl2F3NO2/c8-5-3(7(10,11)12)1-2-4(6(5)9)13(14)15/h1-2H |
| InChI Key | UFVXYWZWRSOUSG-UHFFFAOYSA-N |
| MDL Number | MFCD28787159 |
| Molecular Formula | C7H2Cl2F3NO2 |
| Molecular Weight | 259.9975 |
| SMILES | FC(F)(F)C1=CC=C([N+]([O-])=O)C(Cl)=C1Cl |
| Synonyms | 2,3-dichloro-1-nitro-4-(trifluoromethyl)benzene,
1803801-74-2,
SCHEMBL9350040,
KS-00000LOI,
MFCD28787159,
AKOS027376270,
AK382354,
DS-13742,
|
| Complexity | 256 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 258.941g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 259.993g/mol |
| Monoisotopic Mass | 258.941g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 45.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number