Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
Benzo[b]thiophene-2-ethanol |
EINECS | N/A |
CAS No. | 30962-69-7 | Density | 1.243 g/cm3 |
PSA | 48.47000 | LogP | 2.43610 |
Solubility | N/A | Melting Point |
80.5 °C(Solv: benzene (71-43-2); ligroine (8032-32-4)) |
Formula | C10H10OS | Boiling Point | 327.3 °C at 760 mmHg |
Molecular Weight | 178.255 | Flash Point | 151.8 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-(Benzo[b]thiophen-2-yl)ethanol;2-Benzothiophen-2-ylethanol;NSC 132411;2-Benzo[b]thiophen-2-yl-ethanol; |
Article Data | 8 |
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