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4371-35-1

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Basic Information
CAS No.: 4371-35-1
Name: 1,1'-Biphenyl]-2,2',6,6'-tetrol
Article Data: 12
Molecular Structure:
Molecular Structure of 4371-35-1 (1,1'-Biphenyl]-2,2',6,6'-tetrol)
Formula: C12H10O4
Molecular Weight: 218.209
Synonyms: Biphenyl-2,2',6,6'-tetrol;
Density: 1.47 g/cm3
Melting Point: 244 °C
Boiling Point: 415.921 °C at 760 mmHg
Flash Point: 208.188 °C
PSA: 80.92000
LogP: 2.17600
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Specification

The CAS registry number of [1,1'-Biphenyl]-2,2',6,6'-tetrol is 4371-35-1. The systematic name is biphenyl-2,2',6,6'-tetrol. In addition, the molecular formula is C12H10O4 and the molecular weight is 218.21. What's more, it should be stored in sealed container, and put in a cool and dry place.

Physical properties about [1,1'-Biphenyl]-2,2',6,6'-tetrol are: (1)ACD/LogP: 0.72; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 20; (5)ACD/KOC (pH 7.4): 18; (6)#H bond acceptors: 4; (7)#H bond donors: 4; (8)#Freely Rotating Bonds: 5; (9)Polar Surface Area: 80.92 Å2; (10)Index of Refraction: 1.716; (11)Molar Refractivity: 58.371 cm3; (12)Molar Volume: 148.437 cm3; (13)Polarizability: 23.14 ×10-24cm3; (14)Surface Tension: 77.684 dyne/cm; (15)Density: 1.47 g/cm3; (16)Flash Point: 208.188 °C; (17)Enthalpy of Vaporization: 69.504 kJ/mol; (18)Boiling Point: 415.921 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: Oc2cccc(O)c2c1c(O)cccc1O
(2)InChI: InChI=1/C12H10O4/c13-7-3-1-4-8(14)11(7)12-9(15)5-2-6-10(12)16/h1-6,13-16H
(3)InChIKey: HXBBWWNXODCSPT-UHFFFAOYAY