4-氧代庚二酸
TL;DR: 4-氧代庚二酸 (CAS 502-50-1) is a chemical compound with molecular formula C7H10O5 and molecular weight 174.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-氧代庚二酸
4-oxoheptanedioic acid
Also Known As: 4-Oxoheptanedioic acid, 4-Ketopimelic acid, 4-Oxopimelic acid, 4-Ketopimelic, Cefoxazole
| Molecular Formula | C7H10O5 |
|---|---|
| Molecular Weight | 174.05 g/mol |
| LogP | -1.2 |
| Topological Polar Surface Area | 91.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 174.05283 |
| Heavy Atoms | 12 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 502-50-1 |
|---|---|
| SMILES | C(CC(=O)O)C(=O)CCC(=O)O |
| InChIKey | UDDSEESQRGPVIL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-氧代庚二酸 (CAS 502-50-1), with molecular formula C7H10O5 and molecular weight 174.05 g/mol. IUPAC: 4-oxoheptanedioic acid.
Chemical Property Profile of 4-氧代庚二酸
Property Insights of 4-氧代庚二酸
The XLogP value of -1.2 indicates that 4-氧代庚二酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 91.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-氧代庚二酸. Following Lipinski's Rule of Five, 4-氧代庚二酸 has 2 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 4-氧代庚二酸?
The CAS number of 4-氧代庚二酸 is 502-50-1.
What is the molecular formula of 4-氧代庚二酸?
The molecular formula of 4-氧代庚二酸 is C7H10O5.
What is the molecular weight of 4-氧代庚二酸?
The molecular weight of 4-氧代庚二酸 is 174.05 g/mol.
Where can I buy 4-氧代庚二酸?
You can request a quote for 4-氧代庚二酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-氧代庚二酸?
Yes, KEHONG BIO provides custom synthesis services for 4-氧代庚二酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.