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Cas Database

Name	2-Butanesulfonic acid	EINECS	219-198-7
CAS No.	16794-12-0	Density	1.217g/cm³
PSA	62.75000	LogP	1.75510
Solubility	N/A	Melting Point	N/A
Formula	C₄H₁₀O₃S	Boiling Point	N/A
Molecular Weight	138.188	Flash Point	N/A
Transport Information	N/A	Appearance	N/A
Safety		Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	sec-Butanesulfonicacid;	Article Data	8

2-Butanesulfonic acid Specification

The 2-Butanesulfonic acid with its cas register number is 16794-12-0. It also can be called as sec-Butanesulfonicacid and the IUPAC Name about this chemical is butane-2-sulfonic acid.

Physical properties about 2-Butanesulfonic acid are: (1)ACD/LogD (pH 5.5): -3.53; (2)ACD/LogD (pH 7.4): -3.79; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 3; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 51.75Å²; (11)Index of Refraction: 1.458; (12)Molar Refractivity: 30.91 cm³; (13)Molar Volume: 113.1 cm³; (14)Polarizability: 12.25x10^-24cm³; (15)Surface Tension: 43.9 dyne/cm .

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCC(C)S(=O)(=O)O
(2)InChI: InChI=1S/C4H10O3S/c1-3-4(2)8(5,6)7/h4H,3H2,1-2H3,(H,5,6,7)
(3)InChIKey: BRXCDHOLJPJLLT-UHFFFAOYSA-N

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