Methyl cycloprop-2-ene-1-carboxylate
TL;DR: Methyl cycloprop-2-ene-1-carboxylate (CAS 65248-39-7) is a chemical compound with molecular formula C5H6O2 and molecular weight 98.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl cycloprop-2-ene-1-carboxylate
Also Known As: methyl cycloprop-2-ene-1-carboxylate, methyl 2-cyclo-propenecarboxylate, Methyl 2-cyclopropene-1-carboxylate, 2-cyclopropene-1-carboxylic acid, methyl ester, InChI=1/C5H6O2/c1-7-5(6)4-2-3-4/h2-4H,1H
| Molecular Formula | C5H6O2 |
|---|---|
| Molecular Weight | 98.04 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 98.03678 |
| Heavy Atoms | 7 |
| Complexity | 109.0 |
Chemical Identifiers
| CAS Number | 65248-39-7 |
|---|---|
| SMILES | COC(=O)C1C=C1 |
| InChIKey | KVXGWPOZTQWJPC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl cycloprop-2-ene-1-carboxylate (CAS 65248-39-7), with molecular formula C5H6O2 and molecular weight 98.04 g/mol. IUPAC: methyl cycloprop-2-ene-1-carboxylate.
Chemical Property Profile of Methyl cycloprop-2-ene-1-carboxylate
Property Insights of Methyl cycloprop-2-ene-1-carboxylate
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl cycloprop-2-ene-1-carboxylate. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl cycloprop-2-ene-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl cycloprop-2-ene-1-carboxylate has 0 hydrogen bond donor(s) and 2 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 cycloprop-2-ene-1-carboxylate?
The CAS number of Methyl cycloprop-2-ene-1-carboxylate is 65248-39-7.
What is the molecular formula of Methyl cycloprop-2-ene-1-carboxylate?
The molecular formula of Methyl cycloprop-2-ene-1-carboxylate is C5H6O2.
What is the molecular weight of Methyl cycloprop-2-ene-1-carboxylate?
The molecular weight of Methyl cycloprop-2-ene-1-carboxylate is 98.04 g/mol.
Where can I buy Methyl cycloprop-2-ene-1-carboxylate?
You can request a quote for Methyl cycloprop-2-ene-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl cycloprop-2-ene-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl cycloprop-2-ene-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.