| CAS Number | 170432-54-9 |
| Catalog Number | AG0078RG(AGN-PC-00OPJ1) |
| Chemical Name | 2,3-Difluoro-N-methyl-6-nitroaniline |
| IUPAC Name | 2,3-difluoro-N-methyl-6-nitroaniline |
| InChI | InChI=1S/C7H6F2N2O2/c1-10-7-5(11(12)13)3-2-4(8)6(7)9/h2-3,10H,1H3 |
| InChI Key | QTMMIYSDZZPQFA-UHFFFAOYSA-N |
| MDL Number | MFCD16787128 |
| Molecular Formula | C7H6F2N2O2 |
| Molecular Weight | 188.1315 |
| SMILES | CNC1=C([N+]([O-])=O)C=CC(F)=C1F |
| Synonyms | 2,3-Difluoro-N-methyl-6-nitroaniline,
170432-54-9,
SCHEMBL944514,
ACMC-209e12,
C7H6F2N2O2,
CTK8B0979,
DTXSID70570947,
QTMMIYSDZZPQFA-UHFFFAOYSA-N,
ANW-22452,
MFCD16787128,
ZINC34515938,
AKOS011824044,
CJ-18434,
TC-111197,
V3739,
Benzenamine, 2,3-difluoro-N-methyl-6-nitro-,
B-8779,
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| Complexity | 197 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 188.04g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 188.134g/mol |
| Monoisotopic Mass | 188.04g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 57.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number