Hydroxymethyl butyrate
TL;DR: Hydroxymethyl butyrate (CAS 333354-02-2) is a chemical compound with molecular formula C5H10O3 and molecular weight 118.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hydroxymethyl butanoate
Also Known As: hydroxymethylbutyrate, Hydroxymethyl butyrate, Hydroxymethyl Butanoate
| Molecular Formula | C5H10O3 |
|---|---|
| Molecular Weight | 118.06 g/mol |
| LogP | 0.2795 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 118.062996 |
| Heavy Atoms | 8 |
| Complexity | 62.074036 |
Chemical Identifiers
| CAS Number | 333354-02-2 |
|---|---|
| SMILES | CCCC(=O)OCO |
Product Overview
Hydroxymethyl butyrate (CAS 333354-02-2), with molecular formula C5H10O3 and molecular weight 118.06 g/mol. IUPAC: hydroxymethyl butanoate.
Chemical Property Profile of Hydroxymethyl butyrate
Property Insights of Hydroxymethyl butyrate
The XLogP value of 0.2795 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hydroxymethyl butyrate. With a topological polar surface area (TPSA) of 46.53 Ų, Hydroxymethyl butyrate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hydroxymethyl butyrate 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 Hydroxymethyl butyrate?
The CAS number of Hydroxymethyl butyrate is 333354-02-2.
What is the molecular formula of Hydroxymethyl butyrate?
The molecular formula of Hydroxymethyl butyrate is C5H10O3.
What is the molecular weight of Hydroxymethyl butyrate?
The molecular weight of Hydroxymethyl butyrate is 118.06 g/mol.
Where can I buy Hydroxymethyl butyrate?
You can request a quote for Hydroxymethyl butyrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydroxymethyl butyrate?
Yes, KEHONG BIO provides custom synthesis services for Hydroxymethyl butyrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.