2-Bromo-3,4-Difluoronitrobenzene - CAS 350699-92-2
Catalog: |
BB022409 |
Product Name: |
2-Bromo-3,4-Difluoronitrobenzene |
CAS: |
350699-92-2 |
Synonyms: |
3-bromo-1,2-difluoro-4-nitrobenzene; 3-bromo-1,2-difluoro-4-nitrobenzene |
IUPAC Name: | 3-bromo-1,2-difluoro-4-nitrobenzene |
Description: | 2-Bromo-3,4-Difluoronitrobenzene (CAS# 350699-92-2) is a useful research chemical. |
Molecular Weight: | 237.99 |
Molecular Formula: | C6H2BrF2NO2 |
Canonical SMILES: | C1=CC(=C(C(=C1[N+](=O)[O-])Br)F)F |
InChI: | InChI=1S/C6H2BrF2NO2/c7-5-4(10(11)12)2-1-3(8)6(5)9/h1-2H |
InChI Key: | OANBJAYTIQWYDQ-UHFFFAOYSA-N |
Boiling Point: | 226.7 °C at 760 mmHg |
Density: | 1.89 g/cm3 |
LogP: | 3.15870 |
Publication Number | Title | Priority Date |
US-2021047294-A1 | Imidazolyl pyrimidinylamine compounds as cdk2 inhibitors | 20190814 |
WO-2021030537-A1 | Imidazolyl pyrimidinylamine compounds as cdk2 inhibitors | 20190814 |
TW-202024051-A | Phenoxy-pyridyl-pyrimidine compounds and methods of use | 20180912 |
WO-2018103058-A1 | Inhibitors of bruton's tyrosine kinase and methods of their use | 20161209 |
AU-2016366546-A1 | Inhibitors of bruton's tyrosine kinase and methods of their use | 20151210 |
Complexity: | 187 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 236.9237 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 236.9237 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 45.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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