Name: Name:Acetic acid, 2,2'-sulfonylbis-
Brand: Angene
SKU: AG000JX6
Rating: 90 (10 reviews)

Acetic acid, 2,2'-sulfonylbis-

CAS No.:

123-45-5

Catalog Number:

AG000JX6

Molecular Formula:

C4H6O6S

Molecular Weight:

182.1518

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Product Description

Catalog Number:

AG000JX6

Chemical Name:

Acetic acid, 2,2'-sulfonylbis-

CAS Number:

123-45-5

Molecular Formula:

C4H6O6S

Molecular Weight:

182.1518

MDL Number:

MFCD00054503

IUPAC Name:

2-(carboxymethylsulfonyl)acetic acid

InChI:

InChI=1S/C4H6O6S/c5-3(6)1-11(9,10)2-4(7)8/h1-2H2,(H,5,6)(H,7,8)

InChI Key:

WDYRPTWUNMHTJL-UHFFFAOYSA-N

SMILES:

OC(=O)CS(=O)(=O)CC(=O)O

UNII:

S6Q6X09W62

NSC Number:

93879

Properties

Complexity:

235

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

181.989g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

182.146g/mol

Monoisotopic Mass:

181.989g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

117A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-1.2

Literature

Title	Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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