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Butanedioic acid;butane-1,4-diol structure
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Butanedioic acid;butane-1,4-diol

TL;DR: Butanedioic acid;butane-1,4-diol (CAS 25777-14-4) is a chemical compound with molecular formula C8H16O6 and molecular weight 208.09468 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

butanedioic acid;butane-1,4-diol

Also Known As: butanedioic acid;butane-1,4-diol, butane-1,4-diol succinate, Butanedioic acid, polymer with 1,4-butanediol, PBS - Full Biodegradable Resin, 1,4-BUTANEDIOL SUCCINATE

CAS Number
25777-14-4
Molecular Formula
C8H16O6
Molecular Weight
208.09468 g/mol
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Application Areas

Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (8 patents) Coatings & Adhesives (2 patents) Food Additives (4 patents) Heterocyclic Building Blocks (1 patents) Organic Building Blocks (7 patents)

Technical Specifications

Molecular FormulaC8H16O6
Molecular Weight208.09468 g/mol
XLogP-0.31
Topological Polar Surface Area (TPSA)115.0 Ų
Hydrogen Bond Donors4
Hydrogen Bond Acceptors6
Rotatable Bonds6
Exact Mass208.09468 Da
Heavy Atoms14
Complexity110.0
SMILESC(CCO)CO.C(CC(=O)O)C(=O)O
InChIKeyFQINETJTVSEXPE-UHFFFAOYSA-N

Chemical Property Profile of Butanedioic acid;butane-1,4-diol

XLogP
-0.31
TPSA (Topological Polar Surface Area)
115.0
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
6
Rotatable Bonds
6
Heavy Atoms
14
Complexity
110.0
Exact Mass
208.09468
Monoisotopic Mass
208.09468
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 Butanedioic acid;butane-1,4-diol

The XLogP value of -0.31 indicates that Butanedioic acid;butane-1,4-diol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Butanedioic acid;butane-1,4-diol. Following Lipinski's Rule of Five, Butanedioic acid;butane-1,4-diol has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Butanedioic acid;butane-1,4-diol?

The CAS number of Butanedioic acid;butane-1,4-diol is 25777-14-4.

What is the molecular formula of Butanedioic acid;butane-1,4-diol?

The molecular formula of Butanedioic acid;butane-1,4-diol is C8H16O6.

What is the molecular weight of Butanedioic acid;butane-1,4-diol?

The molecular weight of Butanedioic acid;butane-1,4-diol is 208.09468 g/mol.

Where can I buy Butanedioic acid;butane-1,4-diol?

You can request a quote for Butanedioic acid;butane-1,4-diol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Butanedioic acid;butane-1,4-diol?

Yes, CoreyChem provides custom synthesis services for Butanedioic acid;butane-1,4-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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