2-Mercaptobenzyl alcohol (4521-31-7)

The 2-Mercaptobenzyl alcohol with its cas register number is 4521-31-7. It also can be called as o-Mercaptobenzyl alcohol and the IUPAC Name about this chemical is (2-sulfanylphenyl)methanol. It belongs to the following product categories, such as Organic Building Blocks, Sulfur Compounds, Thiols/Mercaptans and so on. This chemical has risk of serious damage to the eyes. When you are using it, wear eye / face protection.

Physical properties about 2-Mercaptobenzyl alcohol are: (1)ACD/LogP: 1.34; (2)ACD/LogD (pH 5.5): 1.3; (3)ACD/LogD (pH 7.4): 0.43; (4)ACD/BCF (pH 5.5): 5.6; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 116.58; (7)ACD/KOC (pH 7.4): 15.69; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 34.53Ų; (12)Index of Refraction: 1.623; (13)Molar Refractivity: 40.87 cm³; (14)Molar Volume: 115.8 cm³; (15)Polarizability: 16.2x10^-24cm³; (16)Surface Tension: 50.8 dyne/cm; (17)Enthalpy of Vaporization: 54.4 kJ/mol; (18)Vapour Pressure: 0.00231 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C(C(=C1)CO)S
(2)InChI: InChI=1S/C7H8OS/c8-5-6-3-1-2-4-7(6)9/h1-4,8-9H,5H2
(3)InChIKey: FYWFCRHZXORPFH-UHFFFAOYSA-N