Methyl 2,6-Difluoro-4-hydroxybenzoate - CAS 194938-88-0
Catalog: |
BB015092 |
Product Name: |
Methyl 2,6-Difluoro-4-hydroxybenzoate |
CAS: |
194938-88-0 |
Synonyms: |
2,6-difluoro-4-hydroxybenzoic acid methyl ester; methyl 2,6-difluoro-4-hydroxybenzoate |
IUPAC Name: | methyl 2,6-difluoro-4-hydroxybenzoate |
Description: | Methyl 2,6-Difluoro-4-hydroxybenzoate (CAS# 194938-88-0) is a useful research chemical. |
Molecular Weight: | 188.13 |
Molecular Formula: | C8H6F2O3 |
Canonical SMILES: | COC(=O)C1=C(C=C(C=C1F)O)F |
InChI: | InChI=1S/C8H6F2O3/c1-13-8(12)7-5(9)2-4(11)3-6(7)10/h2-3,11H,1H3 |
InChI Key: | ZPVGRBTXDTZVIG-UHFFFAOYSA-N |
LogP: | 1.45700 |
Publication Number | Title | Priority Date |
WO-2020257416-A1 | Targeted protein degradation of parp14 for use in therapy | 20190619 |
TW-201927757-A | Quinazolinone as a PARP14 inhibitor | 20171221 |
US-10562891-B2 | Quinazolinones as PARP14 inhibitors | 20171221 |
US-2019194174-A1 | Quinazolinones as parp14 inhibitors | 20171221 |
WO-2019126443-A1 | Quinazolinones as parp14 inhibitors | 20171221 |
Complexity: | 186 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 188.02850037 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 188.02850037 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 46.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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