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108710-70-9

Basic Information
CAS No.: 108710-70-9
Name: 2-S-thiuronium ethanesulfonate
Molecular Structure:
Molecular Structure of 108710-70-9 (2-S-thiuronium ethanesulfonate)
Formula: C3H8N2O3S2
Molecular Weight: 184.23
Synonyms: 2-[(Aminoiminomethyl)thio]ethanesulfonic acid;
EINECS: 247-391-6
Density: 1.73 g/cm3
Appearance: white crystalline powder
PSA: 137.92000
LogP: 1.38170
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  • 2-(C-aminocarbonimidoyl)sulfanylethanesulfonic acid

  • Casno:

    108710-70-9

    2-(C-aminocarbonimidoyl)sulfanylethanesulfonic acid

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    high purity Application:Drug intermediates Materials intermediates and active molecules

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Specification

The cas register number of 2-[(Aminoiminomethyl)thio]ethanesulfonic acid is 108710-70-9. It also can be called as Ethanesulfonic acid,2-[(aminoiminomethyl-14C)thio]- (9CI) and the Systematic name about this chemical is 2-(carbamimidoylsulfanyl)ethanesulfonic acid.

Physical properties about 2-[(Aminoiminomethyl)thio]ethanesulfonic acid are: (1)ACD/LogP: -2.07; (2)ACD/LogD (pH 5.5): -4.57; (3)ACD/LogD (pH 7.4): -4.59; (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): 1; (8)#H bond acceptors: 5; (9)#H bond donors: 4; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 92.65Å2; (12)Index of Refraction: 1.646; (13)Molar Refractivity: 38.61 cm3; (14)Molar Volume: 106.3 cm3; (15)Polarizability: 15.3x10-24cm3; (16)Surface Tension: 82.8 dyne/cm.

You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(O)CCSC(=[N@H])N
(2)InChI: InChI=1/C3H8N2O3S2/c4-3(5)9-1-2-10(6,7)8/h1-2H2,(H3,4,5)(H,6,7,8)
(3)InChIKey: LTHWZZOUNJCHES-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C3H8N2O3S2/c4-3(5)9-1-2-10(6,7)8/h1-2H2,(H3,4,5)(H,6,7,8)
(5)Std. InChIKey: LTHWZZOUNJCHES-UHFFFAOYSA-N