2-(3-Fluoro-4-nitrophenyl)acetic Acid - CAS 163395-24-2
Catalog: |
BB011997 |
Product Name: |
2-(3-Fluoro-4-nitrophenyl)acetic Acid |
CAS: |
163395-24-2 |
Synonyms: |
2-(3-fluoro-4-nitrophenyl)acetic acid; 2-(3-fluoro-4-nitrophenyl)acetic acid |
IUPAC Name: | 2-(3-fluoro-4-nitrophenyl)acetic acid |
Description: | 2-(3-Fluoro-4-nitrophenyl)acetic Acid (CAS# 163395-24-2) is a useful research chemical. |
Molecular Weight: | 199.14 |
Molecular Formula: | C8H6FNO4 |
Canonical SMILES: | C1=CC(=C(C=C1CC(=O)O)F)[N+](=O)[O-] |
InChI: | InChI=1S/C8H6FNO4/c9-6-3-5(4-8(11)12)1-2-7(6)10(13)14/h1-3H,4H2,(H,11,12) |
InChI Key: | BRWLAOKLDCMHIC-UHFFFAOYSA-N |
LogP: | 1.88420 |
Publication Number | Title | Priority Date |
CA-3068305-A1 | Kinase inhibitors and methods for making and using | 20170629 |
CN-111032642-A | Kinase inhibitors and methods of making and using | 20170629 |
EP-3645525-A1 | Kinase inhibitors and methods for making and using | 20170629 |
US-10590121-B2 | Kinase inhibitors and methods for making and using | 20170629 |
US-2019002455-A1 | Kinase inhibitors and methods for making and using | 20170629 |
Complexity: | 240 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 199.02808583 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 199.02808583 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 83.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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