Methyl 3,4-dihydroxybutanoate
TL;DR: Methyl 3,4-dihydroxybutanoate (CAS 114819-45-3) is a chemical compound with molecular formula C5H10O4 and molecular weight 134.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3,4-dihydroxybutanoate
Also Known As: Dihydromyristicin, Methyl 3,4-dihydroxybutanoate, (S)-methyl 3,4-dihydroxybutanoate, Methyl (S)-3,4-Dihydroxybutanoate, methyl-3,4-dihydroxybutanoate
| Molecular Formula | C5H10O4 |
|---|---|
| Molecular Weight | 134.06 g/mol |
| LogP | -1.0973 |
| Topological Polar Surface Area | 66.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 134.0579 |
| Heavy Atoms | 9 |
| Complexity | 90.958786 |
Chemical Identifiers
| CAS Number | 114819-45-3 |
|---|---|
| SMILES | COC(=O)CC(CO)O |
Product Overview
Methyl 3,4-dihydroxybutanoate (CAS 114819-45-3), with molecular formula C5H10O4 and molecular weight 134.06 g/mol. IUPAC: methyl 3,4-dihydroxybutanoate.
Chemical Property Profile of Methyl 3,4-dihydroxybutanoate
Property Insights of Methyl 3,4-dihydroxybutanoate
The XLogP value of -1.0973 indicates that Methyl 3,4-dihydroxybutanoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 66.76 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3,4-dihydroxybutanoate. Following Lipinski's Rule of Five, Methyl 3,4-dihydroxybutanoate has 2 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 Methyl 3,4-dihydroxybutanoate?
The CAS number of Methyl 3,4-dihydroxybutanoate is 114819-45-3.
What is the molecular formula of Methyl 3,4-dihydroxybutanoate?
The molecular formula of Methyl 3,4-dihydroxybutanoate is C5H10O4.
What is the molecular weight of Methyl 3,4-dihydroxybutanoate?
The molecular weight of Methyl 3,4-dihydroxybutanoate is 134.06 g/mol.
Where can I buy Methyl 3,4-dihydroxybutanoate?
You can request a quote for Methyl 3,4-dihydroxybutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3,4-dihydroxybutanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3,4-dihydroxybutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.