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Name	5-Chloro-benzofuran-3-one	EINECS	N/A
CAS No.	3261-05-0	Density	1.428 g/cm³
PSA	26.30000	LogP	1.91510
Solubility	N/A	Melting Point	117 °C
Formula	C₈H₅ClO₂	Boiling Point	304.3 °C at 760 mmHg
Molecular Weight	168.579	Flash Point	145.6 °C
Transport Information	N/A	Appearance	N/A
Safety		Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	5-Chloro-3-coumaranone;5-Chlorobenzo[b]furan-3(2H)-one;5-Chlorobenzofuran-3(2H)-one;5-Chlorobenzofuran-3-one;	Article Data	20

5-Chloro-benzofuran-3-one Specification

The CAS register number of 3(2H)-Benzofuranone,5-chloro- is 3261-05-0. It also can be called as 5-chloro-2-hydrobenzo[b]furan-3-one and the systematic name about this chemical is 5-chloro-1-benzofuran-3(2H)-one. The molecular formula about this chemical is C₈H₅ClO₂ and the molecular weight is 168.58. It belongs to the Pharmacetical.

Physical properties about 3(2H)-Benzofuranone,5-chloro- are: (1)ACD/LogP: 2.44; (2)#H bond acceptors: 2; (3)Polar Surface Area: 26.3Å²; (4)Index of Refraction: 1.601; (5)Molar Refractivity: 40.44 cm³; (6)Molar Volume: 118 cm³; (7)Polarizability: 16.03x10^-24cm³; (8)Surface Tension: 50.8 dyne/cm; (9)Enthalpy of Vaporization: 54.47 kJ/mol; (10)Boiling Point: 304.3 °C at 760 mmHg; (11)Vapour Pressure: 0.00088 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc2cc1c(OCC1=O)cc2
(2)InChI: InChI=1/C8H5ClO2/c9-5-1-2-8-6(3-5)7(10)4-11-8/h1-3H,4H2
(3)InChIKey: QQCUCXUMVSGDJH-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C8H5ClO2/c9-5-1-2-8-6(3-5)7(10)4-11-8/h1-3H,4H2
(5)Std. InChIKey: QQCUCXUMVSGDJH-UHFFFAOYSA-N

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5-Chloro-benzofuran-3-one Specification