cis-(2R,3R)Methylepoxycinnamate
TL;DR: cis-(2R,3R)Methylepoxycinnamate (CAS 99528-65-1) is a chemical compound with molecular formula C10H7O3- and molecular weight 175.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methylphenyl)oxirene-2-carboxylate
Also Known As: cis-(2R,3R)Methylepoxycinnamate, 3-(2-methylphenyl)oxirene-2-carboxylate
| Molecular Formula | C10H7O3- |
|---|---|
| Molecular Weight | 175.04 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 52.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 175.03952 |
| Heavy Atoms | 13 |
| Complexity | 262.0 |
Chemical Identifiers
| CAS Number | 99528-65-1 |
|---|---|
| SMILES | CC1=CC=CC=C1C2=C(O2)C(=O)[O-] |
| InChIKey | UDDCYRUFMRLBJD-UHFFFAOYSA-M |
Product Overview
cis-(2R,3R)Methylepoxycinnamate (CAS 99528-65-1), with molecular formula C10H7O3- and molecular weight 175.04 g/mol. IUPAC: 3-(2-methylphenyl)oxirene-2-carboxylate.
Chemical Property Profile of cis-(2R,3R)Methylepoxycinnamate
Property Insights of cis-(2R,3R)Methylepoxycinnamate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for cis-(2R,3R)Methylepoxycinnamate. With a topological polar surface area (TPSA) of 52.7 Ų, cis-(2R,3R)Methylepoxycinnamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, cis-(2R,3R)Methylepoxycinnamate has 0 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 cis-(2R,3R)Methylepoxycinnamate?
The CAS number of cis-(2R,3R)Methylepoxycinnamate is 99528-65-1.
What is the molecular formula of cis-(2R,3R)Methylepoxycinnamate?
The molecular formula of cis-(2R,3R)Methylepoxycinnamate is C10H7O3-.
What is the molecular weight of cis-(2R,3R)Methylepoxycinnamate?
The molecular weight of cis-(2R,3R)Methylepoxycinnamate is 175.04 g/mol.
Where can I buy cis-(2R,3R)Methylepoxycinnamate?
You can request a quote for cis-(2R,3R)Methylepoxycinnamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cis-(2R,3R)Methylepoxycinnamate?
Yes, KEHONG BIO provides custom synthesis services for cis-(2R,3R)Methylepoxycinnamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.