3-羟基己二酸
TL;DR: 3-羟基己二酸 (CAS 96426-16-3) is a chemical compound with molecular formula C6H10O5 and molecular weight 162.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-羟基己二酸
3-hydroxyhexanedioic acid
Also Known As: 3-Hydroxyadipic acid, 3-hydroxyhexanedioic acid, 3-Hydroxyadipate, 3-hydroxy-adipic acid, Hexanedioic acid, 3-hydroxy-
| Molecular Formula | C6H10O5 |
|---|---|
| Molecular Weight | 162.05 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 94.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 162.05283 |
| Heavy Atoms | 11 |
| Complexity | 153.0 |
Chemical Identifiers
| CAS Number | 96426-16-3 |
|---|---|
| SMILES | C(CC(=O)O)C(CC(=O)O)O |
| InChIKey | YVOMYDHIQVMMTA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-羟基己二酸 (CAS 96426-16-3), with molecular formula C6H10O5 and molecular weight 162.05 g/mol. IUPAC: 3-hydroxyhexanedioic acid.
Chemical Property Profile of 3-羟基己二酸
Property Insights of 3-羟基己二酸
The XLogP value of -1.0 indicates that 3-羟基己二酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-羟基己二酸. Following Lipinski's Rule of Five, 3-羟基己二酸 has 3 hydrogen bond donor(s) and 5 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 3-羟基己二酸?
The CAS number of 3-羟基己二酸 is 96426-16-3.
What is the molecular formula of 3-羟基己二酸?
The molecular formula of 3-羟基己二酸 is C6H10O5.
What is the molecular weight of 3-羟基己二酸?
The molecular weight of 3-羟基己二酸 is 162.05 g/mol.
Where can I buy 3-羟基己二酸?
You can request a quote for 3-羟基己二酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-羟基己二酸?
Yes, KEHONG BIO provides custom synthesis services for 3-羟基己二酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.