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1918-82-7

Basic Information
CAS No.: 1918-82-7
Name: 2-Vinylthiophene
Article Data: 50
Molecular Structure:
Molecular Structure of 1918-82-7 (2-Vinylthiophene)
Formula: C6H6S
Molecular Weight: 110.18
Synonyms: Thiophene,2-vinyl- (6CI,7CI,8CI);2-Ethenylthiophene;2-Vinylthiophene;Thien-2-ylethene;
Density: 1.05 g/cm3
Boiling Point: 151.7 °C at 760 mmHg
Flash Point: 29.2 °C
PSA: 28.24000
LogP: 2.39110
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Specification

The Thiophene, 2-ethenyl-, with the CAS registry number 1918-82-7, is also known as 2-Vinylthiophene. This chemical's molecular formula is C6H6S and molecular weight is 110.17684. Its IUPAC name is called 2-ethenylthiophene.

Physical properties of Thiophene, 2-ethenyl-: (1)ACD/LogP: 2.52; (2)ACD/LogD (pH 5.5): 2.52; (3)ACD/LogD (pH 7.4): 2.52; (4)ACD/BCF (pH 5.5): 48.02; (5)ACD/BCF (pH 7.4): 48.02; (6)ACD/KOC (pH 5.5): 556.11; (7)ACD/KOC (pH 7.4): 556.11; (8)#Freely Rotating Bonds: 1; (9)Index of Refraction: 1.593; (10)Molar Refractivity: 35.56 cm3; (11)Molar Volume: 104.8 cm3; (12)Surface Tension: 35.1 dyne/cm; (13)Density: 1.05 g/cm3; (14)Flash Point: 29.2 °C; (15)Enthalpy of Vaporization: 37.25 kJ/mol; (16)Boiling Point: 151.7 °C at 760 mmHg; (17)Vapour Pressure: 4.62 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: s1c(\C=C)ccc1
(2)InChI: InChI=1/C6H6S/c1-2-6-4-3-5-7-6/h2-5H,1H2
(3)InChIKey: ORNUPNRNNSVZTC-UHFFFAOYAP