Allyl lactate
TL;DR: Allyl lactate (CAS 5349-55-3) 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.
prop-2-enyl 2-hydroxypropanoate
Also Known As: Allyl lactate, prop-2-en-1-yl 2-hydroxypropanoate, allyl 2-hydroxypropanoate, prop-2-enyl 2-hydroxypropanoate, 2-propenyl 2-hydroxypropionate
| Molecular Formula | C6H10O3 |
|---|---|
| Molecular Weight | 130.06 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 130.06299 |
| Heavy Atoms | 9 |
| Complexity | 109.0 |
Chemical Identifiers
| CAS Number | 5349-55-3 |
|---|---|
| SMILES | CC(C(=O)OCC=C)O |
| InChIKey | CYFIHPJVHCCGTF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Allyl lactate (CAS 5349-55-3), with molecular formula C6H10O3 and molecular weight 130.06 g/mol. IUPAC: prop-2-enyl 2-hydroxypropanoate.
Chemical Property Profile of Allyl lactate
Property Insights of Allyl lactate
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Allyl lactate. With a topological polar surface area (TPSA) of 46.5 Ų, Allyl lactate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Allyl lactate 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 Allyl lactate?
The CAS number of Allyl lactate is 5349-55-3.
What is the molecular formula of Allyl lactate?
The molecular formula of Allyl lactate is C6H10O3.
What is the molecular weight of Allyl lactate?
The molecular weight of Allyl lactate is 130.06 g/mol.
Where can I buy Allyl lactate?
You can request a quote for Allyl lactate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Allyl lactate?
Yes, KEHONG BIO provides custom synthesis services for Allyl lactate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.