Butane-1,3-diol;hexanedioic acid
TL;DR: Butane-1,3-diol;hexanedioic acid (CAS 163205-75-2) is a chemical compound with molecular formula C10H20O6 and molecular weight 236.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butane-1,3-diol;hexanedioic acid
Also Known As: butane-1,3-diol;hexanedioic acid, Hexanedioic acid, polymer with 1,3-butanediol, adipic acid; butane-1,3-diol, butane-1,3-diol; hexanedioic acid, 1,3-Butylene glycol, adipic acid polymer
| Molecular Formula | C10H20O6 |
|---|---|
| Molecular Weight | 236.13 g/mol |
| LogP | 0.4656 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 236.12599 |
| Heavy Atoms | 16 |
| Complexity | 142.0 |
Chemical Identifiers
| CAS Number | 163205-75-2 |
|---|---|
| SMILES | CC(CCO)O.C(CCC(=O)O)CC(=O)O |
| InChIKey | KKPMZLPPEXRJOM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butane-1,3-diol;hexanedioic acid (CAS 163205-75-2), with molecular formula C10H20O6 and molecular weight 236.13 g/mol. IUPAC: butane-1,3-diol;hexanedioic acid.
Chemical Property Profile of Butane-1,3-diol;hexanedioic acid
Property Insights of Butane-1,3-diol;hexanedioic acid
The XLogP value of 0.4656 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butane-1,3-diol;hexanedioic acid. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Butane-1,3-diol;hexanedioic acid. Following Lipinski's Rule of Five, Butane-1,3-diol;hexanedioic acid 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
Frequently Asked Questions
What is the CAS number of Butane-1,3-diol;hexanedioic acid?
The CAS number of Butane-1,3-diol;hexanedioic acid is 163205-75-2.
What is the molecular formula of Butane-1,3-diol;hexanedioic acid?
The molecular formula of Butane-1,3-diol;hexanedioic acid is C10H20O6.
What is the molecular weight of Butane-1,3-diol;hexanedioic acid?
The molecular weight of Butane-1,3-diol;hexanedioic acid is 236.13 g/mol.
Where can I buy Butane-1,3-diol;hexanedioic acid?
You can request a quote for Butane-1,3-diol;hexanedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butane-1,3-diol;hexanedioic acid?
Yes, KEHONG BIO provides custom synthesis services for Butane-1,3-diol;hexanedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.