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17113-33-6

Basic Information
CAS No.: 17113-33-6
Name: 2-PHENYL-FURAN
Article Data: 153
Molecular Structure:
Molecular Structure of 17113-33-6 (2-PHENYL-FURAN)
Formula: C10H8O
Molecular Weight: 144.173
Synonyms: 2-Phenylfuran;2-Phenyl-furan;
Density: 1.048 g/cm3
Melting Point: 161 °C
Boiling Point: 222.4 °C at 760 mmHg
Flash Point: 86.4 °C
PSA: 13.14000
LogP: 2.94660
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Specification

The Furan, 2-phenyl-, with the CAS registry number 17113-33-6, is also known as 2-Phenyl-furan. This chemical's molecular formula is C10H8O and molecular weight is 144.17. What's more, its systematic name is 2-phenylfuran.

Physical properties of Furan, 2-phenyl- are: (1)ACD/LogP: 3.17; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.17; (4)ACD/LogD (pH 7.4): 3.17; (5)ACD/BCF (pH 5.5): 150.56; (6)ACD/BCF (pH 7.4): 150.56; (7)ACD/KOC (pH 5.5): 1260.1; (8)ACD/KOC (pH 7.4): 1260.1; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 13.14 Å2; (13)Index of Refraction: 1.539; (14)Molar Refractivity: 43.14 cm3; (15)Molar Volume: 137.5 cm3; (16)Polarizability: 17.1×10-24cm3; (17)Surface Tension: 35 dyne/cm; (18)Density: 1.048 g/cm3; (19)Flash Point: 86.4 °C; (20)Enthalpy of Vaporization: 44.02 kJ/mol; (21)Boiling Point: 222.4 °C at 760 mmHg; (22)Vapour Pressure: 0.151 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: o2c(c1ccccc1)ccc2
(2)InChI: InChI=1S/C10H8O/c1-2-5-9(6-3-1)10-7-4-8-11-10/h1-8H
(3)InChIKey: GCXNJAXHHFZVIM-UHFFFAOYSA-N