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121739-44-4

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Basic Information
CAS No.: 121739-44-4
Name: 1,3-Thiazolidin-2-ol
Molecular Structure:
Molecular Structure of 121739-44-4 (1,3-Thiazolidin-2-ol)
Formula: C3H7NOS
Molecular Weight: 105.1588
Synonyms: 2-Hydroxythiazolidine;
Density: 1.294 g/cm3
Boiling Point: 257.7 °C at 760 mmHg
Flash Point: 109.7 °C
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Specification

The 1,3-Thiazolidin-2-ol is an organic compound with the formula C3H7NOS. With the CAS registry number 121739-44-4, the IUPAC name of this chemical is 1,3-thiazolidin-2-ol.

Physical properties about 1,3-Thiazolidin-2-ol are: (1)ACD/LogP: -0.91; (2)ACD/LogD (pH 5.5): -2.5; (3)ACD/LogD (pH 7.4): -1.08; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 5.09; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 37.77 Å2; (12)Index of Refraction: 1.577; (13)Molar Refractivity: 26.93 cm3; (14)Molar Volume: 81.2 cm3; (15)Polarizability: 10.67×10-24cm3; (16)Surface Tension: 49.3 dyne/cm; (17)Density: 1.294 g/cm3; (18)Flash Point: 109.7 °C; (19)Enthalpy of Vaporization: 57.53 kJ/mol; (20)Boiling Point: 257.7 °C at 760 mmHg; (21)Vapour Pressure: 0.00212 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: OC1SCCN1
(2)InChI: InChI=1/C3H7NOS/c5-3-4-1-2-6-3/h3-5H,1-2H2
(3)InChIKey: QQZVYINTKUPKGJ-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C3H7NOS/c5-3-4-1-2-6-3/h3-5H,1-2H2
(5)Std. InChIKey: QQZVYINTKUPKGJ-UHFFFAOYSA-N