(1S)-2-Hydroxy-1-methylethyl 2-propenoate
TL;DR: (1S)-2-Hydroxy-1-methylethyl 2-propenoate (CAS 2180189-77-7) 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.
[(2S)-1-hydroxypropan-2-yl] prop-2-enoate
Also Known As: (2S)-1-Hydroxypropan-2-yl prop-2-enoate, (1S)-2-Hydroxy-1-methylethyl 2-propenoate
| Molecular Formula | C6H10O3 |
|---|---|
| Molecular Weight | 130.06 g/mol |
| LogP | 0.0964 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 130.06299 |
| Heavy Atoms | 9 |
| Complexity | 108.8706 |
Chemical Identifiers
| CAS Number | 2180189-77-7 |
|---|---|
| SMILES | C[C@@H](CO)OC(=O)C=C |
Product Overview
(1S)-2-Hydroxy-1-methylethyl 2-propenoate (CAS 2180189-77-7), with molecular formula C6H10O3 and molecular weight 130.06 g/mol. IUPAC: [(2S)-1-hydroxypropan-2-yl] prop-2-enoate.
Chemical Property Profile of (1S)-2-Hydroxy-1-methylethyl 2-propenoate
Property Insights of (1S)-2-Hydroxy-1-methylethyl 2-propenoate
The XLogP value of 0.0964 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1S)-2-Hydroxy-1-methylethyl 2-propenoate. With a topological polar surface area (TPSA) of 46.53 Ų, (1S)-2-Hydroxy-1-methylethyl 2-propenoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1S)-2-Hydroxy-1-methylethyl 2-propenoate 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 (1S)-2-Hydroxy-1-methylethyl 2-propenoate?
The CAS number of (1S)-2-Hydroxy-1-methylethyl 2-propenoate is 2180189-77-7.
What is the molecular formula of (1S)-2-Hydroxy-1-methylethyl 2-propenoate?
The molecular formula of (1S)-2-Hydroxy-1-methylethyl 2-propenoate is C6H10O3.
What is the molecular weight of (1S)-2-Hydroxy-1-methylethyl 2-propenoate?
The molecular weight of (1S)-2-Hydroxy-1-methylethyl 2-propenoate is 130.06 g/mol.
Where can I buy (1S)-2-Hydroxy-1-methylethyl 2-propenoate?
You can request a quote for (1S)-2-Hydroxy-1-methylethyl 2-propenoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1S)-2-Hydroxy-1-methylethyl 2-propenoate?
Yes, KEHONG BIO provides custom synthesis services for (1S)-2-Hydroxy-1-methylethyl 2-propenoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.