1,2-Difluoro-3-methyl-4-nitrobenzene - CAS 914348-35-9
Catalog: |
BB040188 |
Product Name: |
1,2-Difluoro-3-methyl-4-nitrobenzene |
CAS: |
914348-35-9 |
Synonyms: |
1,2-difluoro-3-methyl-4-nitrobenzene; 1,2-difluoro-3-methyl-4-nitrobenzene |
IUPAC Name: | 1,2-difluoro-3-methyl-4-nitrobenzene |
Description: | 1,2-Difluoro-3-methyl-4-nitrobenzene (CAS# 914348-35-9) is a useful research chemical. |
Molecular Weight: | 173.12 |
Molecular Formula: | C7H5F2NO2 |
Canonical SMILES: | CC1=C(C=CC(=C1F)F)[N+](=O)[O-] |
InChI: | InChI=1S/C7H5F2NO2/c1-4-6(10(11)12)3-2-5(8)7(4)9/h2-3H,1H3 |
InChI Key: | ODMLBEQUDLHJMW-UHFFFAOYSA-N |
Boiling Point: | 223.728 ℃ at 760 mmHg |
Density: | 1.374 g/cm3 |
LogP: | 2.70460 |
Publication Number | Title | Priority Date |
CA-3103120-A1 | Chemical compounds | 20191220 |
US-2021188829-A1 | Chemical Compounds | 20191220 |
WO-2021124155-A1 | Benzimidazole derivatives | 20191220 |
WO-2020192581-A1 | Wee1 inhibitor and preparation and use thereof | 20190322 |
AU-2018228114-A1 | AGENT ENHANCING ANTITUMOR EFFECT USING PYRAZOLO[3,4-d]PYRIMIDINE COMPOUND | 20170228 |
Complexity: | 183 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 173.02883473 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 173.02883473 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 45.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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