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Basic Information
CAS No.: 3265-72-3
Name: 4,5,6,7-TETRAFLUORO-2-METHYL-1-BENZOFURAN-3-CARBOXYLIC ACID
Molecular Structure:
Molecular Structure of 3265-72-3 (4,5,6,7-TETRAFLUORO-2-METHYL-1-BENZOFURAN-3-CARBOXYLIC ACID)
Formula: C10H4F4O3
Molecular Weight: 248.134
Synonyms: CID7129061;ZINC04206307;
Density: 1.632 g/cm3
Boiling Point: 340.1 °C at 760 mmHg
Flash Point: 159.5 °C
PSA: 50.44000
LogP: 2.99580
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Specification

The 3-Benzofurancarboxylicacid, 4,5,6,7-tetrafluoro-2-methyl-, with the CAS registry number 3265-72-3, is also known as CID7129061. This chemical's molecular formula is C10H4F4O3 and molecular weight is 248.1306. Its IUPAC name is called 4,5,6,7-tetrafluoro-2-methyl-1-benzofuran-3-carboxylate.

Physical properties of 3-Benzofurancarboxylicacid, 4,5,6,7-tetrafluoro-2-methyl-: (1)ACD/LogP: 2.89; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 3; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 1; (9)Index of Refraction: 1.545; (10)Molar Refractivity: 48.12 cm3; (11)Molar Volume: 151.9 cm3; (12)Surface Tension: 44.8 dyne/cm; (13)Density: 1.632 g/cm3; (14)Flash Point: 159.5 °C; (15)Enthalpy of Vaporization: 61.6 kJ/mol; (16)Boiling Point: 340.1 °C at 760 mmHg; (17)Vapour Pressure: 3.4E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=C(C2=C(O1)C(=C(C(=C2F)F)F)F)C(=O)[O-]
(2)InChI: InChI=1S/C10H4F4O3/c1-2-3(10(15)16)4-5(11)6(12)7(13)8(14)9(4)17-2/h1H3,(H,15,16)/p-1
(3)InChIKey: PCQIMPCKDMEBLS-UHFFFAOYSA-M