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7597-68-4

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Basic Information
CAS No.: 7597-68-4
Name: Ethyl 2-(1-benzothiophen-3-yl)acetate
Article Data: 4
Molecular Structure:
Molecular Structure of 7597-68-4 (Ethyl 2-(1-benzothiophen-3-yl)acetate)
Formula: C12H12O2S
Molecular Weight: 220.29
Synonyms: NSC 42320;
Density: 1.208 g/cm3
Boiling Point: 331.8 °C at 760 mmHg
Flash Point: 154.4 °C
PSA: 54.54000
LogP: 3.00690
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  • Ethyl 2-(1-benzothiophen-3-yl)acetate CAS NO.7597-68-4

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    Ethyl 2-(1-benzothiophen-3-yl)acetate CAS NO.7597-68-4

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Specification

The Ethyl 2-(1-benzothiophen-3-yl)acetate with its cas register number is 7597-68-4. It also can be called as and the IUPAC Name about this chemical is ethyl 2-(1-benzothiophen-3-yl)acetate.

Physical properties about Ethyl 2-(1-benzothiophen-3-yl)acetate are: (1)#H bond acceptors: 2; (2)#Freely Rotating Bonds: 4; (3)Polar Surface Area: 54.54Å2; (4)Index of Refraction: 1.608; (5)Molar Refractivity: 63.06 cm3; (6)Molar Volume: 182.3 cm3; (7)Polarizability: 25x10-24cm3; (8)Surface Tension: 46.1 dyne/cm; (9)Enthalpy of Vaporization: 57.45 kJ/mol; (10)Vapour Pressure: 0.000152 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCOC(=O)CC1=CSC2=CC=CC=C21
(2)InChI: InChI=1S/C12H12O2S/c1-2-14-12(13)7-9-8-15-11-6-4-3-5-10(9)11/h3-6,8H,2,7H2,1H3
(3)InChIKey: QAJKYZFZTOKLRE-UHFFFAOYSA-N