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Benzenesulfonic acid, 2,2'-thiobis(5-nitro- structure
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Benzenesulfonic acid, 2,2'-thiobis(5-nitro-

TL;DR: Benzenesulfonic acid, 2,2'-thiobis(5-nitro- (CAS 63216-88-6) is a chemical compound with molecular formula C12H8N2O10S3 and molecular weight 435.9341 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

5-nitro-2-(4-nitro-2-sulfophenyl)sulfanylbenzenesulfonic acid

Also Known As: benzenesulfonic acid, 2,2'-thiobis[5-nitro-, Bis(2-sulfo-4-nitrophenyl) sulfide, 2,2'-Thiobis(5-nitrobenzenesulphonic) acid, Benzenesulfonic acid, 2,2'-thiobis(5-nitro-, 2,2'-Thiobis(5-nitrobenzenesulfonic) acid

CAS Number
63216-88-6
Molecular Formula
C12H8N2O10S3
Molecular Weight
435.9341 g/mol
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Technical Specifications

Molecular FormulaC12H8N2O10S3
Molecular Weight435.9341 g/mol
XLogP1.1
Topological Polar Surface Area (TPSA)242.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors11
Rotatable Bonds4
Exact Mass435.9341 Da
Heavy Atoms27
Complexity710.0
SMILESC1=CC(=C(C=C1[N+](=O)[O-])S(=O)(=O)O)SC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O
InChIKeyLVUFXZAHTLUDST-UHFFFAOYSA-N

Chemical Property Profile of Benzenesulfonic acid, 2,2'-thiobis(5-nitro-

XLogP
1.1
TPSA (Topological Polar Surface Area)
242.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
11
Rotatable Bonds
4
Heavy Atoms
27
Complexity
710.0
Exact Mass
435.9341
Monoisotopic Mass
435.9341
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Benzenesulfonic acid, 2,2'-thiobis(5-nitro-

The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenesulfonic acid, 2,2'-thiobis(5-nitro-. The TPSA of 242.0 Ų indicates high polarity, suggesting Benzenesulfonic acid, 2,2'-thiobis(5-nitro- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Benzenesulfonic acid, 2,2'-thiobis(5-nitro- has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Benzenesulfonic acid, 2,2'-thiobis(5-nitro-?

The CAS number of Benzenesulfonic acid, 2,2'-thiobis(5-nitro- is 63216-88-6.

What is the molecular formula of Benzenesulfonic acid, 2,2'-thiobis(5-nitro-?

The molecular formula of Benzenesulfonic acid, 2,2'-thiobis(5-nitro- is C12H8N2O10S3.

What is the molecular weight of Benzenesulfonic acid, 2,2'-thiobis(5-nitro-?

The molecular weight of Benzenesulfonic acid, 2,2'-thiobis(5-nitro- is 435.9341 g/mol.

Where can I buy Benzenesulfonic acid, 2,2'-thiobis(5-nitro-?

You can request a quote for Benzenesulfonic acid, 2,2'-thiobis(5-nitro- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Benzenesulfonic acid, 2,2'-thiobis(5-nitro-?

Yes, CoreyChem provides custom synthesis services for Benzenesulfonic acid, 2,2'-thiobis(5-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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