2-Amino-6-fluoro-3-methylbenzoic Acid - CAS 874804-26-9
Catalog: |
BB038483 |
Product Name: |
2-Amino-6-fluoro-3-methylbenzoic Acid |
CAS: |
874804-26-9 |
Synonyms: |
2-amino-6-fluoro-3-methylbenzoic acid; 2-amino-6-fluoro-3-methylbenzoic acid |
IUPAC Name: | 2-amino-6-fluoro-3-methylbenzoic acid |
Description: | 2-Amino-6-fluoro-3-methylbenzoic Acid (CAS# 874804-26-9 ) is a useful research chemical. |
Molecular Weight: | 169.15 |
Molecular Formula: | C8H8FNO2 |
Canonical SMILES: | CC1=C(C(=C(C=C1)F)C(=O)O)N |
InChI: | InChI=1S/C8H8FNO2/c1-4-2-3-5(9)6(7(4)10)8(11)12/h2-3H,10H2,1H3,(H,11,12) |
InChI Key: | LQGPVQQUWJIZAH-UHFFFAOYSA-N |
LogP: | 1.99570 |
Publication Number | Title | Priority Date |
WO-2021046315-A2 | Inhibitors of encephalitic alphaviruses | 20190905 |
WO-2016071485-A1 | Method for determining the composition of the sugar moiety of a sugar containing compound | 20141107 |
EP-3180332-A1 | Difluoropyrrolidines as orexin receptor modulators | 20140813 |
JP-2017524005-A | Difluoropyrrolidine as an orexin receptor modulator | 20140813 |
JP-6663909-B2 | Difluoropyrrolidine as an orexin receptor modulator | 20140813 |
Complexity: | 186 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 169.05390666 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 169.05390666 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 63.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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