Catalog Number | ACM1201316-2 |
CAS | 1201-31-6 |
Structure | |
Description | 2,3,4,5-Tetrafluorobenzoic Acid is used in the synthesis of diterpenoid analogs as antitumor compounds. Also used in the synthesis of novel quinoline lactones. |
Synonyms | 2,3,4,5-tetrafluoro benzoic acid;F0293-0125;2-H-C6F4COOH;2,3,3′,4′,5,5′,6-HEPTACHLOROBIPHENYL;2,3,4,5-Tetrafluorobenzoic Acid |
Molecular Formula | C7H2F4O2 |
Melting Point | 85-88ºC |
Flash Point | 98.5ºC |
Density | 1.633 g/cm³ |
Appearance | White to pale yellow powder |
Content | 98.0% Min |
What is the molecular formula of 2,3,4,5-Tetrafluorobenzoic acid?
The molecular formula is C7H2F4O2.
What is the molecular weight of 2,3,4,5-Tetrafluorobenzoic acid?
The molecular weight is 194.08 g/mol.
How is the IUPAC name of 2,3,4,5-Tetrafluorobenzoic acid computed?
It is computed as 2,3,4,5-tetrafluorobenzoic acid.
What is the InChI of 2,3,4,5-Tetrafluorobenzoic acid?
The InChI is InChI=1S/C7H2F4O2/c8-3-1-2(7(12)13)4(9)6(11)5(3)10/h1H,(H,12,13).
What is the InChIKey of 2,3,4,5-Tetrafluorobenzoic acid?
The InChIKey is SFKRXQKJTIYUAG-UHFFFAOYSA-N.
What is the Canonical SMILES of 2,3,4,5-Tetrafluorobenzoic acid?
The Canonical SMILES is C1=C(C(=C(C(=C1F)F)F)F)C(=O)O.
What is the CAS number of 2,3,4,5-Tetrafluorobenzoic acid?
The CAS number is 1201-31-6.
What is the XLogP3-AA value of 2,3,4,5-Tetrafluorobenzoic acid?
The XLogP3-AA value is 1.8.
How many hydrogen bond acceptor counts does 2,3,4,5-Tetrafluorobenzoic acid have?
It has 6 hydrogen bond acceptor counts.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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