CAS No.30962-69-7,2-BENZO[B]THIOPHEN-2-YL-ETHANOL Suppliers

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Basic Information

Molecular Structure:
CAS No.:	30962-69-7
Name:	2-BENZO[B]THIOPHEN-2-YL-ETHANOL
Article Data:	8

Formula:	C₁₀H₁₀OS
Molecular Weight:	178.255
Synonyms:	2-(Benzo[b]thiophen-2-yl)ethanol;2-Benzothiophen-2-ylethanol;NSC 132411;2-Benzo[b]thiophen-2-yl-ethanol;
Density:	1.243 g/cm³
Melting Point:	80.5 °C(Solv: benzene (71-43-2); ligroine (8032-32-4))
Boiling Point:	327.3 °C at 760 mmHg
Flash Point:	151.8 °C
PSA:	48.47000
LogP:	2.43610

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Specification

The Benzo[b]thiophene-2-ethanol, with the CAS registry number 30962-69-7, has the systematic name and IUPAC name of 2-(1-benzothiophen-2-yl)ethanol. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C₁₀H₁₀OS.

The characteristics of Benzo[b]thiophene-2-ethanol are as followings: (1)ACD/LogP: 3.52; (2)# of Rule of 5 Violations: 0 ; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 37.47 Å²; (7)Index of Refraction: 1.67; (8)Molar Refractivity: 53.56 cm³; (9)Molar Volume: 143.3 cm³; (10)Polarizability: 21.23×10^-24cm³; (11)Surface Tension: 53.4 dyne/cm; (12)Density: 1.243 g/cm³; (13)Flash Point: 151.8 °C; (14)Enthalpy of Vaporization: 60.13 kJ/mol; (15)Boiling Point: 327.3 °C at 760 mmHg; (16)Vapour Pressure: 8.25E-05 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: OCCc2sc1ccccc1c2
(2)InChI: InChI=1/C10H10OS/c11-6-5-9-7-8-3-1-2-4-10(8)12-9/h1-4,7,11H,5-6H2
(3)InChIKey: AMFBMJOMAZEXAO-UHFFFAOYAO