Cyclopentanecarboxylic acid, 3-methylene-5-prop-2-enoic acid, dimethyl ester-
TL;DR: Cyclopentanecarboxylic acid, 3-methylene-5-prop-2-enoic acid, dimethyl ester- (CAS 82823-81-2) is a chemical compound with molecular formula C12H16O4 and molecular weight 224.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(E)-3-methoxy-3-oxoprop-1-enyl]-4-methylidenecyclopentane-1-carboxylate
Also Known As: Cyclopentanecarboxylic acid, 3-methylene-5-prop-2-enoic acid, dimethyl ester-, methyl (E)-(2-(methoxycarbonyl)-4-methylenecyclopent-1-yl)propenoate, Methyl 2-[(1E)-3-methoxy-3-oxo-1-propenyl]-4-methylenecyclopentanecarboxylate #, methyl 2-[(E)-3-methoxy-3-oxoprop-1-enyl]-4-methylidenecyclopentane-1-carboxylate
| Molecular Formula | C12H16O4 |
|---|---|
| Molecular Weight | 224.10 g/mol |
| LogP | 1.471 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 224.10486 |
| Heavy Atoms | 16 |
| Complexity | 329.91046 |
Chemical Identifiers
| CAS Number | 82823-81-2 |
|---|---|
| SMILES | COC(=O)/C=C/C1CC(=C)CC1C(=O)OC |
Product Overview
Cyclopentanecarboxylic acid, 3-methylene-5-prop-2-enoic acid, dimethyl ester- (CAS 82823-81-2), with molecular formula C12H16O4 and molecular weight 224.10 g/mol. IUPAC: methyl 2-[(E)-3-methoxy-3-oxoprop-1-enyl]-4-methylidenecyclopentane-1-carboxylate.
Chemical Property Profile of Cyclopentanecarboxylic acid, 3-methylene-5-prop-2-enoic acid, dimethyl ester-
Property Insights of Cyclopentanecarboxylic acid, 3-methylene-5-prop-2-enoic acid, dimethyl ester-
The XLogP value of 1.471 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclopentanecarboxylic acid, 3-methylene-5-prop-2-enoic acid, dimethyl ester-. With a topological polar surface area (TPSA) of 52.6 Ų, Cyclopentanecarboxylic acid, 3-methylene-5-prop-2-enoic acid, dimethyl ester- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclopentanecarboxylic acid, 3-methylene-5-prop-2-enoic acid, dimethyl ester- has 0 hydrogen bond donor(s) and 4 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 Cyclopentanecarboxylic acid, 3-methylene-5-prop-2-enoic acid, dimethyl ester-?
The CAS number of Cyclopentanecarboxylic acid, 3-methylene-5-prop-2-enoic acid, dimethyl ester- is 82823-81-2.
What is the molecular formula of Cyclopentanecarboxylic acid, 3-methylene-5-prop-2-enoic acid, dimethyl ester-?
The molecular formula of Cyclopentanecarboxylic acid, 3-methylene-5-prop-2-enoic acid, dimethyl ester- is C12H16O4.
What is the molecular weight of Cyclopentanecarboxylic acid, 3-methylene-5-prop-2-enoic acid, dimethyl ester-?
The molecular weight of Cyclopentanecarboxylic acid, 3-methylene-5-prop-2-enoic acid, dimethyl ester- is 224.10 g/mol.
Where can I buy Cyclopentanecarboxylic acid, 3-methylene-5-prop-2-enoic acid, dimethyl ester-?
You can request a quote for Cyclopentanecarboxylic acid, 3-methylene-5-prop-2-enoic acid, dimethyl ester- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclopentanecarboxylic acid, 3-methylene-5-prop-2-enoic acid, dimethyl ester-?
Yes, KEHONG BIO provides custom synthesis services for Cyclopentanecarboxylic acid, 3-methylene-5-prop-2-enoic acid, dimethyl ester- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.