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CAS No.: | 171877-39-7 |
---|---|
Name: | (S)-4-BENZYL-1,3-THIAZOLIDINE-2-THIONE |
Article Data: | 22 |
Molecular Structure: | |
Formula: | C10H11NS2 |
Molecular Weight: | 209.336 |
Synonyms: | 2-Thiazolidinethione,4-(phenylmethyl)-, (S)-;(S)-4-(Phenylmethyl)-2-thiazolidinethione; |
Density: | 1.27g/cm3 |
Melting Point: | 93-94℃ |
Boiling Point: | 328.397 °C at 760 mmHg |
Flash Point: | 152.409 °C |
Hazard Symbols: | Xi, Xn |
Risk Codes: | 20/21/22-36/37/38 |
Safety: | 26-36 |
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The 2-Thiazolidinethione,4-(phenylmethyl)-, (4S)- is an organic compound with the formula C10H11NS2. The systematic name of this chemical is (4S)-4-Benzyl-1,3-thiazolidine-2-thione. With the CAS registry number 171877-39-7, it is also named as (S)-4-Benzyl-thiazolidine-2-thione. Besides, its molecular weight is 209.33.
Physical properties about 2-Thiazolidinethione,4-(phenylmethyl)-, (4S)- are: (1)ACD/LogP: 3.05; (2)ACD/LogD (pH 5.5): 3; (3)ACD/LogD (pH 7.4): 3; (4)ACD/BCF (pH 5.5): 103; (5)ACD/BCF (pH 7.4): 103; (6)ACD/KOC (pH 5.5): 962; (7)ACD/KOC (pH 7.4): 962; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 69.42 Å2; (12)Index of Refraction: 1.676; (13)Molar Refractivity: 61.987 cm3; (14)Molar Volume: 164.772 cm3; (15)Polarizability: 24.574×10-24 cm3; (16)Surface Tension: 60.569 dyne/cm; (17)Density: 1.27 g/cm3; (18)Flash Point: 152.409 °C; (19)Enthalpy of Vaporization: 57.078 kJ/mol; (20)Boiling Point: 328.397 °C at 760 mmHg.
When you are using this chemical, please be cautious about it as the following:
It is harmful by inhalation, in contact with skin and if swallowed. Besides, this chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing. 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)InChI: InChI=1/C10H11NS2/c12-10-11-9(7-13-10)6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,11,12)/t9-/m0/s1
(2)InChIKey: SLDUGQISGRPGAW-VIFPVBQEBF
(3)Std. InChI: InChI=1S/C10H11NS2/c12-10-11-9(7-13-10)6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,11,12)/t9-/m0/s1
(4)Std. InChIKey: SLDUGQISGRPGAW-VIFPVBQESA-N