2-酮-3-脱氧-1,7-二羧基庚酸
TL;DR: 2-酮-3-脱氧-1,7-二羧基庚酸 (CAS 6631-07-8) is a chemical compound with molecular formula C7H10O8 and molecular weight 222.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-酮-3-脱氧-1,7-二羧基庚酸
2,3,4-trihydroxy-6-oxoheptanedioic acid
Also Known As: Dlhl acid, 2-Kddha, 3-deoxyhept-2-ulosaric acid, 2,3,4-trihydroxy-6-oxoheptanedioic acid, 2-Keto-3-deoxy-1,7-dicarboxyheptonic acid
| Molecular Formula | C7H10O8 |
|---|---|
| Molecular Weight | 222.04 g/mol |
| LogP | -2.7 |
| Topological Polar Surface Area | 152.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 222.03757 |
| Heavy Atoms | 15 |
| Complexity | 272.0 |
Chemical Identifiers
| CAS Number | 6631-07-8 |
|---|---|
| SMILES | C(C(C(C(C(=O)O)O)O)O)C(=O)C(=O)O |
| InChIKey | IEBQXKOEWCQOHR-UHFFFAOYSA-N |
Product Overview
2-酮-3-脱氧-1,7-二羧基庚酸 (CAS 6631-07-8), with molecular formula C7H10O8 and molecular weight 222.04 g/mol. IUPAC: 2,3,4-trihydroxy-6-oxoheptanedioic acid.
Chemical Property Profile of 2-酮-3-脱氧-1,7-二羧基庚酸
Property Insights of 2-酮-3-脱氧-1,7-二羧基庚酸
The XLogP value of -2.7 indicates that 2-酮-3-脱氧-1,7-二羧基庚酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 152.0 Ų indicates high polarity, suggesting 2-酮-3-脱氧-1,7-二羧基庚酸 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-酮-3-脱氧-1,7-二羧基庚酸 has 5 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 2-酮-3-脱氧-1,7-二羧基庚酸?
The CAS number of 2-酮-3-脱氧-1,7-二羧基庚酸 is 6631-07-8.
What is the molecular formula of 2-酮-3-脱氧-1,7-二羧基庚酸?
The molecular formula of 2-酮-3-脱氧-1,7-二羧基庚酸 is C7H10O8.
What is the molecular weight of 2-酮-3-脱氧-1,7-二羧基庚酸?
The molecular weight of 2-酮-3-脱氧-1,7-二羧基庚酸 is 222.04 g/mol.
Where can I buy 2-酮-3-脱氧-1,7-二羧基庚酸?
You can request a quote for 2-酮-3-脱氧-1,7-二羧基庚酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-酮-3-脱氧-1,7-二羧基庚酸?
Yes, KEHONG BIO provides custom synthesis services for 2-酮-3-脱氧-1,7-二羧基庚酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.