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859850-66-1

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Basic Information
CAS No.: 859850-66-1
Name: 2-(4-ISOCYANATOPHENYL)FURAN
Molecular Structure:
Molecular Structure of 859850-66-1 (2-(4-ISOCYANATOPHENYL)FURAN)
Formula: C11H7NO2
Molecular Weight: 185.182
Synonyms: 2-(4-ISOCYANATOPHENYL)FURAN;2-(4-Isocyanatophenyl)furan 95%
Density: 1.14 g/cm3
Melting Point: 66 °C
Boiling Point: 280.2 °C at 760 mmHg
Flash Point: 123.3 °C
PSA: 42.57000
LogP: 2.91390
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Specification

The Furan,2-(4-isocyanatophenyl)- is an organic compound with the formula C11H7NO2. The systematic name of this chemical is 2-(4-Isocyanatophenyl)furan. The CAS registry number of this chemical is 859850-66-1. Besides, its molecular weight is 185.18.

Physical properties about Furan,2-(4-isocyanatophenyl)- are: (1)ACD/LogP: 3.23; (2)ACD/LogD (pH 5.5): 3.23; (3)ACD/LogD (pH 7.4): 3.23; (4)ACD/BCF (pH 5.5): 168.95; (5)ACD/BCF (pH 7.4): 168.95; (6)ACD/KOC (pH 5.5): 1368.5; (7)ACD/KOC (pH 7.4): 1368.5; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 42.57 Å2; (11)Index of Refraction: 1.577; (12)Molar Refractivity: 53.43 cm3; (13)Molar Volume: 161.1 cm3; (14)Polarizability: 21.18×10-24 cm3; (15)Surface Tension: 43.6 dyne/cm; (16)Density: 1.14 g/cm3; (17)Flash Point: 123.3 °C; (18)Enthalpy of Vaporization: 51.9 kJ/mol; (19)Boiling Point: 280.2 °C at 760 mmHg; (20)Vapour Pressure: 0.00383 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C11H7NO2/c13-8-12-10-5-3-9(4-6-10)11-2-1-7-14-11/h1-7H
(2)InChIKey: VSHIYROPEPGJND-UHFFFAOYAF
(3)Std. InChI: InChI=1S/C11H7NO2/c13-8-12-10-5-3-9(4-6-10)11-2-1-7-14-11/h1-7H
(4)Std. InChIKey: VSHIYROPEPGJND-UHFFFAOYSA-N