己二酰双膦酸
TL;DR: 己二酰双膦酸 (CAS 1188546-10-2) is a chemical compound with molecular formula C6H12O8P2 and molecular weight 274.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
己二酰双膦酸
(6-oxo-6-phosphonohexanoyl)phosphonic acid
Also Known As: AdBP, Adipoylbisphosphonic acid, adipoylbisphosphonicacid, (6-oxo-6-phosphonohexanoyl)phosphonic acid, (1,6-Dioxohexane-1,6-diyl)bis(phosphonic acid)
| Molecular Formula | C6H12O8P2 |
|---|---|
| Molecular Weight | 274.00 g/mol |
| LogP | -3.3 |
| Topological Polar Surface Area | 149.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 274.00073 |
| Heavy Atoms | 16 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 1188546-10-2 |
|---|---|
| SMILES | C(CCC(=O)P(=O)(O)O)CC(=O)P(=O)(O)O |
| InChIKey | KNDMIUZIFQENCC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
己二酰双膦酸 (CAS 1188546-10-2), with molecular formula C6H12O8P2 and molecular weight 274.00 g/mol. IUPAC: (6-oxo-6-phosphonohexanoyl)phosphonic acid.
Chemical Property Profile of 己二酰双膦酸
Property Insights of 己二酰双膦酸
The XLogP value of -3.3 indicates that 己二酰双膦酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 149.0 Ų indicates high polarity, suggesting 己二酰双膦酸 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 己二酰双膦酸 has 4 hydrogen bond donor(s) and 8 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 己二酰双膦酸?
The CAS number of 己二酰双膦酸 is 1188546-10-2.
What is the molecular formula of 己二酰双膦酸?
The molecular formula of 己二酰双膦酸 is C6H12O8P2.
What is the molecular weight of 己二酰双膦酸?
The molecular weight of 己二酰双膦酸 is 274.00 g/mol.
Where can I buy 己二酰双膦酸?
You can request a quote for 己二酰双膦酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 己二酰双膦酸?
Yes, KEHONG BIO provides custom synthesis services for 己二酰双膦酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.