Benzo[b]thiophen-7(4H)-one,5,6-dihydro- supplier

Name
5,6-DIHYDRO-1-BENZOTHIOPHENE-7(4H)-ONE
EINECS
CAS No. 1468-84-4
Article Data1
CAS DataBase
Density 1.245 g/cm³
Solubility
Melting Point
Formula C₈H₈OS
Boiling Point 267.006 °C at 760 mmHg
Molecular Weight 152.217
Flash Point 115.281 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 5,6-Dihydro-1-benzothiophen-7(4H)-one;
PSA 45.31000
LogP 2.26710

Benzo[b]thiophen-7(4H)-one,5,6-dihydro- Specification

The Benzo[b]thiophen-7(4H)-one,5,6-dihydro-, with the CAS registry number 1468-84-4, is also known as 5,6-Dihydro-1-benzothiophen-7(4H)-one. This chemical's molecular formula is C₈H₈OS and molecular weight is 152.2135. What's more, its systematic name is called 5,6-Dihydro-4H-benzothiophen-7-one.

Physical properties about Benzo[b]thiophen-7(4H)-one,5,6-dihydro- are: (1)ACD/LogP: 0.98; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.98; (4)ACD/LogD (pH 7.4): 0.98; (5)ACD/BCF (pH 5.5): 3.271; (6)ACD/BCF (pH 7.4): 3.271; (7)ACD/KOC (pH 5.5): 81.282; (8)ACD/KOC (pH 7.4): 81.282; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 45.31 Å²; (13)Index of Refraction: 1.595; (14)Molar Refractivity: 41.554 cm³; (15)Molar Volume: 122.24 cm³; (16)Polarizability: 16.473×10^-24 cm³; (17)Surface Tension: 48.527 dyne/cm; (18)Density: 1.245 g/cm³; (19)Flash Point: 115.281 °C; (20)Enthalpy of Vaporization: 50.501 kJ/mol; (21)Boiling Point: 267.006 °C at 760 mmHg; (22)Vapour Pressure: 0.008 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: c1csc2c1CCCC2=O
(2) InChI: InChI=1/C8H8OS/c9-7-3-1-2-6-4-5-10-8(6)7/h4-5H,1-3H2
(3) InChIKey: JEJQJCKVMQVOHZ-UHFFFAOYAU

Product Name

5,6-DIHYDRO-1-BENZOTHIOPHENE-7(4H)-ONE

Benzo[b]thiophen-7(4H)-one,5,6-dihydro- Specification

Related Products

Hot Products