3,4-Difluorophenylglyoxal - CAS 79784-34-2
Catalog: |
BB036410 |
Product Name: |
3,4-Difluorophenylglyoxal |
CAS: |
79784-34-2 |
Synonyms: |
2-(3,4-difluorophenyl)-2-oxoacetaldehyde;hydrate; 2-(3,4-difluorophenyl)-2-oxoacetaldehyde;hydrate |
IUPAC Name: | 2-(3,4-difluorophenyl)-2-oxoacetaldehyde;hydrate |
Description: | 3,4-Difluorophenylglyoxal (CAS# 79784-34-2) is a useful research chemical. |
Molecular Weight: | 170.11 |
Molecular Formula: | C8H4F2O2 |
Canonical SMILES: | C1=CC(=C(C=C1C(=O)C=O)F)F.O |
InChI: | InChI=1S/C8H4F2O2.H2O/c9-6-2-1-5(3-7(6)10)8(12)4-11;/h1-4H;1H2 |
InChI Key: | FFYIMFMDGMXVOF-UHFFFAOYSA-N |
Boiling Point: | 229.4 °C at 760 mmHg |
Density: | 1.342 g/cm3 |
Appearance: | Powder |
MDL: | MFCD03453081 |
LogP: | 1.28210 |
Publication Number | Title | Priority Date |
CN-110357891-A | The 2- hydroxypyrrole derivatives and its synthetic method and application that chromone base replaces | 20190705 |
AU-2008331480-A1 | Prolyl hydroxylase inhibitors | 20071130 |
AU-2012258439-A1 | Prolyl hydroxylase inhibitors | 20071130 |
CN-101983384-A | Prolyl hydroxylase inhibitors | 20071130 |
EP-2227770-A2 | Prolyl hydroxylase inhibitors | 20071130 |
Complexity: | 194 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
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: | 35.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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