CAS 14752-66-0 | Benzenesulfinic acid, 4-chloro-, sodium salt (1:1) | CAS Number 14752-66-0

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14752-66-0 | Benzenesulfinic acid, 4-chloro-, sodium salt (1:1)

CAS No: 14752-66-0 Catalog No: AG001EYT MDL No:MFCD00035602

Product Description

Catalog Number:

AG001EYT

Chemical Name:

Benzenesulfinic acid, 4-chloro-, sodium salt (1:1)

CAS Number:

14752-66-0

Molecular Formula:

C6H4ClNaO2S

Molecular Weight:

198.6025

MDL Number:

MFCD00035602

IUPAC Name:

sodium;4-chlorobenzenesulfinate

InChI:

InChI=1S/C6H5ClO2S.Na/c7-5-1-3-6(4-2-5)10(8)9;/h1-4H,(H,8,9);/q;+1/p-1

InChI Key:

JFXAUUFCZJYLJF-UHFFFAOYSA-M

SMILES:

Clc1ccc(cc1)S(=O)[O-].[Na+]

EC Number:

238-811-9

UNII:

X2U129FZ4N

Properties

Complexity:

137

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

197.952g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

198.596g/mol

Monoisotopic Mass:

197.952g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

59.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

Literature

Title	Journal
New synthetic sulfone derivatives inhibit growth, adhesion and the leucine arylamidase APE2 gene expression of Candida albicans in vitro.	Bioorganic & medicinal chemistry 20150115
S-benzylisothiourea derivatives as small-molecule inhibitors of indoleamine-2,3-dioxygenase.	Bioorganic & medicinal chemistry letters 20100901