2,6-Difluoro-3-formylbenzoic Acid - CAS 1500192-09-5
Catalog: |
BB055829 |
Product Name: |
2,6-Difluoro-3-formylbenzoic Acid |
CAS: |
1500192-09-5 |
Synonyms: |
2,6-Difluoro-3-formylbenzoic acid; 2,6-Difluoro-3-formylbenzoicacid |
IUPAC Name: | 2,6-difluoro-3-formylbenzoic acid |
Description: | 2,6-Difluoro-3-formylbenzoic acid (cas# 1500192-09-5) is a useful research chemical for organic synthesis. |
Molecular Weight: | 186.11 |
Molecular Formula: | C8H4O3F2 |
Canonical SMILES: | C1=CC(=C(C(=C1C=O)F)C(=O)O)F |
InChI: | InChI=1S/C8H4F2O3/c9-5-2-1-4(3-11)7(10)6(5)8(12)13/h1-3H,(H,12,13) |
InChI Key: | XVPIDIHUAXNMEP-UHFFFAOYSA-N |
Melting Point: | >103°C (dec.) |
Solubility: | DMSO (Slightly), Methanol (Slightly, Heated) |
Appearance: | White to Off-White Solid |
Storage: | Hygroscopic, -20°C Freezer, Under inert atmosphere |
Complexity: | 219 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 186.01285031 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 186.01285031 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 54.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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