Carbonic acid, 4-cycloocten-1-yl methyl ester
TL;DR: Carbonic acid, 4-cycloocten-1-yl methyl ester (CAS 87731-18-8) is a chemical compound with molecular formula C10H16O3 and molecular weight 184.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(4Z)-cyclooct-4-en-1-yl] methyl carbonate
Also Known As: Violiff, methoxycarbonyloxycyclooct-4-ene, Carbonic acid, 4-cycloocten-1-yl methyl ester, Cyclooct-4-en-1-yl methyl carbonate, [(4Z)-cyclooct-4-en-1-yl] methyl carbonate
| Molecular Formula | C10H16O3 |
|---|---|
| Molecular Weight | 184.11 g/mol |
| LogP | 2.6583 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 184.10994 |
| Heavy Atoms | 13 |
| Complexity | 186.60889 |
Chemical Identifiers
| CAS Number | 87731-18-8 |
|---|---|
| SMILES | COC(=O)OC1CCC/C=C\CC1 |
Product Overview
Carbonic acid, 4-cycloocten-1-yl methyl ester (CAS 87731-18-8), with molecular formula C10H16O3 and molecular weight 184.11 g/mol. IUPAC: [(4Z)-cyclooct-4-en-1-yl] methyl carbonate.
Chemical Property Profile of Carbonic acid, 4-cycloocten-1-yl methyl ester
Property Insights of Carbonic acid, 4-cycloocten-1-yl methyl ester
The XLogP value of 2.6583 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbonic acid, 4-cycloocten-1-yl methyl ester. With a topological polar surface area (TPSA) of 35.53 Ų, Carbonic acid, 4-cycloocten-1-yl methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbonic acid, 4-cycloocten-1-yl methyl ester 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 Carbonic acid, 4-cycloocten-1-yl methyl ester?
The CAS number of Carbonic acid, 4-cycloocten-1-yl methyl ester is 87731-18-8.
What is the molecular formula of Carbonic acid, 4-cycloocten-1-yl methyl ester?
The molecular formula of Carbonic acid, 4-cycloocten-1-yl methyl ester is C10H16O3.
What is the molecular weight of Carbonic acid, 4-cycloocten-1-yl methyl ester?
The molecular weight of Carbonic acid, 4-cycloocten-1-yl methyl ester is 184.11 g/mol.
Where can I buy Carbonic acid, 4-cycloocten-1-yl methyl ester?
You can request a quote for Carbonic acid, 4-cycloocten-1-yl methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbonic acid, 4-cycloocten-1-yl methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbonic acid, 4-cycloocten-1-yl methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.