3-Fluoro-N-methyl-2-nitroaniline - CAS 947255-02-9
Catalog: |
BB041477 |
Product Name: |
3-Fluoro-N-methyl-2-nitroaniline |
CAS: |
947255-02-9 |
Synonyms: |
3-fluoro-N-methyl-2-nitroaniline; 3-fluoro-N-methyl-2-nitroaniline |
IUPAC Name: | 3-fluoro-N-methyl-2-nitroaniline |
Description: | 3-Fluoro-N-methyl-2-nitroaniline (CAS# 947255-02-9 ) is a useful research chemical. |
Molecular Weight: | 170.14 |
Molecular Formula: | C7H7FN2O2 |
Canonical SMILES: | CNC1=C(C(=CC=C1)F)[N+](=O)[O-] |
InChI: | InChI=1S/C7H7FN2O2/c1-9-6-4-2-3-5(8)7(6)10(11)12/h2-4,9H,1H3 |
InChI Key: | JBYOOHVCUSDDCE-UHFFFAOYSA-N |
Storage: | 2-8 °C |
LogP: | 2.37180 |
Publication Number | Title | Priority Date |
WO-2020162471-A1 | Pyridone derivative | 20190208 |
WO-2020132269-A1 | Substituted pyrazolopyrimidines and substituted purines and their use as ubiquitin-specific-processing protease 1 (usp1) inhibitors | 20181220 |
TW-202039501-A | Substituted pyrazolopyrimidines and substituted purines and their use as ubiquitin-specific-processing protease 1 (usp1) inhibitors | 20181220 |
US-2021115049-A1 | Substituted pyrazolopyrimidines and substituted purines and their use as ubiquitin-specific-processing protease 1 (usp1) inhibitors | 20181220 |
CN-113164485-A | Substituted pyrazolopyrimidines and substituted purines and their use as inhibitors of ubiquitin-specific processing protease 1(USP1) | 20181220 |
Complexity: | 171 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 170.04915563 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 170.04915563 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 57.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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