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Bisnorlipoate structure
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Bisnorlipoate

TL;DR: Bisnorlipoate (CAS 13125-44-5) is a chemical compound with molecular formula C6H10O2S2 and molecular weight 178.01222 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-(dithiolan-3-yl)propanoic acid

Also Known As: Bisnorlipoic acid, Bisnorlipoate, Bisnorthioctic acid, 1,2-Dithiolane-3-propanoic acid, 4,6-Dithiohexanoate

CAS Number
13125-44-5
Molecular Formula
C6H10O2S2
Molecular Weight
178.01222 g/mol
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Application Areas

Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (1 patents) Biotechnology (1 patents) Heterocyclic Building Blocks (13 patents) Pharmaceutical Intermediates (8 patents)

Technical Specifications

Molecular FormulaC6H10O2S2
Molecular Weight178.01222 g/mol
XLogP1.0
Topological Polar Surface Area (TPSA)87.9 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors4
Rotatable Bonds3
Exact Mass178.01222 Da
Heavy Atoms10
Complexity127.0
SMILESC1CSSC1CCC(=O)O
InChIKeyRGQLDLUVIDCIBI-UHFFFAOYSA-N

Chemical Property Profile of Bisnorlipoate

XLogP
1.0
TPSA (Topological Polar Surface Area)
87.9
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
4
Rotatable Bonds
3
Heavy Atoms
10
Complexity
127.0
Exact Mass
178.01222
Monoisotopic Mass
178.01222
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 Bisnorlipoate

The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bisnorlipoate. The TPSA of 87.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Bisnorlipoate. Following Lipinski's Rule of Five, Bisnorlipoate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Bisnorlipoate?

The CAS number of Bisnorlipoate is 13125-44-5.

What is the molecular formula of Bisnorlipoate?

The molecular formula of Bisnorlipoate is C6H10O2S2.

What is the molecular weight of Bisnorlipoate?

The molecular weight of Bisnorlipoate is 178.01222 g/mol.

Where can I buy Bisnorlipoate?

You can request a quote for Bisnorlipoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Bisnorlipoate?

Yes, CoreyChem provides custom synthesis services for Bisnorlipoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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