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3-(2-Thienyl)benzyl alcohol

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Name

3-(2-Thienyl)benzyl alcohol

EINECS N/A
CAS No. 103669-00-7 Density 1.204 g/cm3
PSA 48.47000 LogP 2.90740
Solubility N/A Melting Point 46 °C
Formula C11H10OS Boiling Point 333 °C at 760 mmHg
Molecular Weight 190.26 Flash Point 155.2 °C
Transport Information N/A Appearance N/A
Safety 22-26-36/37/39 Risk Codes 20/22-36/37/38
Molecular Structure Molecular Structure of 103669-00-7 (3-(2-Thienyl)benzyl alcohol) Hazard Symbols
Synonyms

3-(2-Thienyl)benzylalcohol;

Article Data 3

3-(2-Thienyl)benzyl alcohol Specification

The 3-(2-Thienyl)benzyl alcohol with its cas register number is 103669-00-7. It also can be called as (3-Thien-2-ylphenyl)methanol and the Systematic name about this chemical is (3-thiophen-2-ylphenyl)methanol. It belongs to the API intermediates.

Physical properties about 3-(2-Thienyl)benzyl alcohol are: (1)ACD/LogP: 2.60; (2)ACD/LogD (pH 5.5): 2.6; (3)ACD/LogD (pH 7.4): 2.6; (4)ACD/BCF (pH 5.5): 55.39; (5)ACD/BCF (pH 7.4): 55.39; (6)ACD/KOC (pH 5.5): 616.01; (7)ACD/KOC (pH 7.4): 616.01; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 37.47Å2; (12)Index of Refraction: 1.622; (13)Molar Refractivity: 55.68 cm3; (14)Molar Volume: 158 cm3; (15)Polarizability: 22.07x10-24cm3; (16)Surface Tension: 48.6 dyne/cm; (17)Enthalpy of Vaporization: 60.78 kJ/mol; (18)Vapour Pressure: 5.57E-05 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is harmful by inhalation and if swallowed and it is irritating to eyes, respiratory system and skin. When you are using it, please not breathe dust.and wear suitable gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: OCc1cccc(c1)c2sccc2
(2)InChI: InChI=1/C11H10OS/c12-8-9-3-1-4-10(7-9)11-5-2-6-13-11/h1-7,12H,8H2
(3)InChIKey: SATFADRDDGOLJP-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C11H10OS/c12-8-9-3-1-4-10(7-9)11-5-2-6-13-11/h1-7,12H,8H2
(5)Std. InChlKey: SATFADRDDGOLJP-UHFFFAOYSA-N

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