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245762-35-0

Basic Information
CAS No.: 245762-35-0
Name: 5-Fluoro-2,3-dihydrobenzo[b]furan
Article Data: 8
Molecular Structure:
Molecular Structure of 245762-35-0 (5-Fluoro-2,3-dihydrobenzo[b]furan)
Formula: C8H7FO
Molecular Weight: 138.141
Synonyms: 5-Fluoro-2,3-dihydrobenzofuran;
EINECS: 246-331-6
Density: 1.214 g/cm3
Boiling Point: 191.559 °C at 760 mmHg
Flash Point: 67.719 °C
Hazard Symbols: IrritantXi
Risk Codes: 22
PSA: 9.23000
LogP: 1.76060
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  • 5-FLUORO-2,3-DIHYDROBENZOFURAN  CAS NO.245762-35-0

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Specification

The 5-Fluoro-2,3-dihydrobenzo[b]furan, with CAS registry number 245762-35-0, has the systematic name of 5-fluoro-2,3-dihydro-1-benzofuran. Besides this, it is also called benzofuran, 5-fluoro-2,3-dihydro-. And the chemical formula of this chemical is C8H7FO.

Physical properties of 5-Fluoro-2,3-dihydrobenzo[b]furan: (1)ACD/LogP: 2.45; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 31; (6)ACD/BCF (pH 7.4): 31; (7)ACD/KOC (pH 5.5): 407; (8)ACD/KOC (pH 7.4): 407; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.535; (14)Molar Refractivity: 35.414 cm3; (15)Molar Volume: 113.778 cm3; (16)Polarizability: 14.039×10-24cm3; (17)Surface Tension: 39.473 dyne/cm; (18)Enthalpy of Vaporization: 41.025 kJ/mol; (19)Vapour Pressure: 0.711 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cc2CCOc2cc1
(2)InChI: InChI=1/C8H7FO/c9-7-1-2-8-6(5-7)3-4-10-8/h1-2,5H,3-4H2
(3)InChIKey: PAVTXINZFWRQOD-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C8H7FO/c9-7-1-2-8-6(5-7)3-4-10-8/h1-2,5H,3-4H2
(5)Std. InChIKey: PAVTXINZFWRQOD-UHFFFAOYSA-N