Product Name

(S)-6-Chloro-2-(3-methoxypropyl)-3,4-dihydro-2H-thieno[3,2-e][1,2]thiazin-4-ol 1,1-dioxide Specification

The (S)-6-Chloro-2-(3-methoxypropyl)-3,4-dihydro-2H-thieno[3,2-e][1,2]thiazin-4-ol 1,1-dioxide is an organic compound with the formula C10H14ClNO4S2. With the CAS registry number 160982-13-8, the systematic name of this chemical is 6-chloro-2-(3-methoxypropyl)-3,4-dihydro-2H-thieno[3,2-e][1,2]thiazin-4-ol 1,1-dioxide.

Physical properties about (S)-6-Chloro-2-(3-methoxypropyl)-3,4-dihydro-2H-thieno[3,2-e][1,2]thiazin-4-ol 1,1-dioxide are: (1)ACD/LogP: 3.10; (2)ACD/LogD (pH 5.5): 1; (3)ACD/LogD (pH 7.4): 1; (4)ACD/BCF (pH 5.5): 4; (5)ACD/BCF (pH 7.4): 4; (6)ACD/KOC (pH 5.5): 93; (7)ACD/KOC (pH 7.4): 93; (8)#H bond acceptors: 5; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 5; (11)Polar Surface Area: 103.46 Å2; (12)Index of Refraction: 1.598; (13)Molar Refractivity: 71.409 cm3; (14)Molar Volume: 209.263 cm3; (15)Polarizability: 28.309×10-24cm3; (16)Surface Tension: 57.429 dyne/cm; (17)Density: 1.49 g/cm3; (18)Flash Point: 235.714 °C; (19)Enthalpy of Vaporization: 76.688 kJ/mol; (20)Boiling Point: 466.142 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1sc2c(c1)C(O)CN(CCCOC)S2(=O)=O
(2)InChI: InChI=1/C10H14ClNO4S2/c1-16-4-2-3-12-6-8(13)7-5-9(11)17-10(7)18(12,14)15/h5,8,13H,2-4,6H2,1H3
(3)InChIKey: FMNGDEKOOMHKNT-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C10H14ClNO4S2/c1-16-4-2-3-12-6-8(13)7-5-9(11)17-10(7)18(12,14)15/h5,8,13H,2-4,6H2,1H3
(5)Std. InChIKey: FMNGDEKOOMHKNT-UHFFFAOYSA-N

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