α-酮-β-甲基戊酸
TL;DR: α-酮-β-甲基戊酸 (CAS 1460-34-0) is a chemical compound with molecular formula C6H10O3 and molecular weight 130.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
α-酮-β-甲基戊酸
3-methyl-2-oxopentanoic acid
Also Known As: 3-Methyl-2-oxovaleric acid, 3-Methyl-2-oxopentanoic acid, ketoisoleucine, 2-oxoisoleucine, alpha-ketoisoleucine
| Molecular Formula | C6H10O3 |
|---|---|
| Molecular Weight | 130.06 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 130.06299 |
| Heavy Atoms | 9 |
| Complexity | 128.0 |
| Solubility | Soluble in water |
Chemical Identifiers
| CAS Number | 1460-34-0 |
|---|---|
| SMILES | CCC(C)C(=O)C(=O)O |
| InChIKey | JVQYSWDUAOAHFM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
α-酮-β-甲基戊酸 (CAS 1460-34-0), with molecular formula C6H10O3 and molecular weight 130.06 g/mol. IUPAC: 3-methyl-2-oxopentanoic acid.
Chemical Property Profile of α-酮-β-甲基戊酸
Property Insights of α-酮-β-甲基戊酸
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for α-酮-β-甲基戊酸. With a topological polar surface area (TPSA) of 54.4 Ų, α-酮-β-甲基戊酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, α-酮-β-甲基戊酸 has 1 hydrogen bond donor(s) and 3 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 α-酮-β-甲基戊酸?
The CAS number of α-酮-β-甲基戊酸 is 1460-34-0.
What is the molecular formula of α-酮-β-甲基戊酸?
The molecular formula of α-酮-β-甲基戊酸 is C6H10O3.
What is the molecular weight of α-酮-β-甲基戊酸?
The molecular weight of α-酮-β-甲基戊酸 is 130.06 g/mol.
Where can I buy α-酮-β-甲基戊酸?
You can request a quote for α-酮-β-甲基戊酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for α-酮-β-甲基戊酸?
Yes, KEHONG BIO provides custom synthesis services for α-酮-β-甲基戊酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.