Cyclopropanecarboxylic acid, 3-(2-carboxy-1-propenyl)-2,2-dimethyl-
TL;DR: Cyclopropanecarboxylic acid, 3-(2-carboxy-1-propenyl)-2,2-dimethyl- (CAS 497-95-0) is a chemical compound with molecular formula C10H14O4 and molecular weight 198.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-carboxyprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylic acid
Also Known As: Chrysanthemumdicarboxylic acid, Cyclopropanecarboxylic acid, 3-(2-carboxy-1-propenyl)-2,2-dimethyl-, 3-(2-carboxyprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylic acid, 3-CARBOXY-alpha-2,2-TRIMETHYL-CYCLOPROPANEACRYLIC ACID, 3-(2-carboxyprop-1-enyl)-2,2-dimethylcyclopropanecarboxylic acid
| Molecular Formula | C10H14O4 |
|---|---|
| Molecular Weight | 198.09 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 198.0892 |
| Heavy Atoms | 14 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 497-95-0 |
|---|---|
| SMILES | CC(=CC1C(C1(C)C)C(=O)O)C(=O)O |
| InChIKey | XXTFGUFRXPWYDA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyclopropanecarboxylic acid, 3-(2-carboxy-1-propenyl)-2,2-dimethyl- (CAS 497-95-0), with molecular formula C10H14O4 and molecular weight 198.09 g/mol. IUPAC: 3-(2-carboxyprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylic acid.
Chemical Property Profile of Cyclopropanecarboxylic acid, 3-(2-carboxy-1-propenyl)-2,2-dimethyl-
Property Insights of Cyclopropanecarboxylic acid, 3-(2-carboxy-1-propenyl)-2,2-dimethyl-
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclopropanecarboxylic acid, 3-(2-carboxy-1-propenyl)-2,2-dimethyl-. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Cyclopropanecarboxylic acid, 3-(2-carboxy-1-propenyl)-2,2-dimethyl-. Following Lipinski's Rule of Five, Cyclopropanecarboxylic acid, 3-(2-carboxy-1-propenyl)-2,2-dimethyl- has 2 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 Cyclopropanecarboxylic acid, 3-(2-carboxy-1-propenyl)-2,2-dimethyl-?
The CAS number of Cyclopropanecarboxylic acid, 3-(2-carboxy-1-propenyl)-2,2-dimethyl- is 497-95-0.
What is the molecular formula of Cyclopropanecarboxylic acid, 3-(2-carboxy-1-propenyl)-2,2-dimethyl-?
The molecular formula of Cyclopropanecarboxylic acid, 3-(2-carboxy-1-propenyl)-2,2-dimethyl- is C10H14O4.
What is the molecular weight of Cyclopropanecarboxylic acid, 3-(2-carboxy-1-propenyl)-2,2-dimethyl-?
The molecular weight of Cyclopropanecarboxylic acid, 3-(2-carboxy-1-propenyl)-2,2-dimethyl- is 198.09 g/mol.
Where can I buy Cyclopropanecarboxylic acid, 3-(2-carboxy-1-propenyl)-2,2-dimethyl-?
You can request a quote for Cyclopropanecarboxylic acid, 3-(2-carboxy-1-propenyl)-2,2-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclopropanecarboxylic acid, 3-(2-carboxy-1-propenyl)-2,2-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for Cyclopropanecarboxylic acid, 3-(2-carboxy-1-propenyl)-2,2-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.