(3R)-3-(methoxycarbonyl)-5-methylhexanoate
TL;DR: (3R)-3-(methoxycarbonyl)-5-methylhexanoate (CAS 130165-76-3) is a chemical compound with molecular formula C9H15O4- and molecular weight 187.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R)-3-methoxycarbonyl-5-methylhexanoate
Also Known As: 3-(Methoxycarbonyl)-5-methylhexanoate, (3R)-3-methoxycarbonyl-5-methylhexanoate, (3R)-3-(methoxycarbonyl)-5-methylhexanoate, Butanedioic acid, 2-(2-methylpropyl)-, 1-methyl ester, (2R)-
| Molecular Formula | C9H15O4- |
|---|---|
| Molecular Weight | 187.10 g/mol |
| LogP | -0.0383 |
| Topological Polar Surface Area | 66.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 187.09703 |
| Heavy Atoms | 13 |
| Complexity | 186.05373 |
Chemical Identifiers
| CAS Number | 130165-76-3 |
|---|---|
| SMILES | CC(C)C[C@H](CC(=O)[O-])C(=O)OC |
Product Overview
(3R)-3-(methoxycarbonyl)-5-methylhexanoate (CAS 130165-76-3), with molecular formula C9H15O4- and molecular weight 187.10 g/mol. IUPAC: (3R)-3-methoxycarbonyl-5-methylhexanoate.
Chemical Property Profile of (3R)-3-(methoxycarbonyl)-5-methylhexanoate
Property Insights of (3R)-3-(methoxycarbonyl)-5-methylhexanoate
The XLogP value of -0.0383 indicates that (3R)-3-(methoxycarbonyl)-5-methylhexanoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 66.43 Ų falls within the moderate polarity range, balancing permeability and solubility for (3R)-3-(methoxycarbonyl)-5-methylhexanoate. Following Lipinski's Rule of Five, (3R)-3-(methoxycarbonyl)-5-methylhexanoate has 0 hydrogen bond donor(s) and 4 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 (3R)-3-(methoxycarbonyl)-5-methylhexanoate?
The CAS number of (3R)-3-(methoxycarbonyl)-5-methylhexanoate is 130165-76-3.
What is the molecular formula of (3R)-3-(methoxycarbonyl)-5-methylhexanoate?
The molecular formula of (3R)-3-(methoxycarbonyl)-5-methylhexanoate is C9H15O4-.
What is the molecular weight of (3R)-3-(methoxycarbonyl)-5-methylhexanoate?
The molecular weight of (3R)-3-(methoxycarbonyl)-5-methylhexanoate is 187.10 g/mol.
Where can I buy (3R)-3-(methoxycarbonyl)-5-methylhexanoate?
You can request a quote for (3R)-3-(methoxycarbonyl)-5-methylhexanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3R)-3-(methoxycarbonyl)-5-methylhexanoate?
Yes, KEHONG BIO provides custom synthesis services for (3R)-3-(methoxycarbonyl)-5-methylhexanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.