4-(2-羧基乙烯基)苯甲酸甲酯
TL;DR: 4-(2-羧基乙烯基)苯甲酸甲酯 (CAS 19473-96-2) is a chemical compound with molecular formula C11H10O4 and molecular weight 206.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-羧基乙烯基)苯甲酸甲酯
3-(4-methoxycarbonylphenyl)prop-2-enoic acid
Also Known As: p-Carbomethoxycinnamic Acid, 1-Methyl 4-(2-carboxyvinyl)benzoate, 4-carbomethoxycinnamic acid, 4-methoxycarbonylcinnamic acid, p-Methoxycarbonylcinnamic Acid
| Molecular Formula | C11H10O4 |
|---|---|
| Molecular Weight | 206.06 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 206.0579 |
| Heavy Atoms | 15 |
| Complexity | 262.0 |
Chemical Identifiers
| CAS Number | 19473-96-2 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)C=CC(=O)O |
| InChIKey | PVHMYONDAPXJSB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(2-羧基乙烯基)苯甲酸甲酯 (CAS 19473-96-2), with molecular formula C11H10O4 and molecular weight 206.06 g/mol. IUPAC: 3-(4-methoxycarbonylphenyl)prop-2-enoic acid.
Chemical Property Profile of 4-(2-羧基乙烯基)苯甲酸甲酯
Property Insights of 4-(2-羧基乙烯基)苯甲酸甲酯
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-羧基乙烯基)苯甲酸甲酯. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-羧基乙烯基)苯甲酸甲酯. Following Lipinski's Rule of Five, 4-(2-羧基乙烯基)苯甲酸甲酯 has 1 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 4-(2-羧基乙烯基)苯甲酸甲酯?
The CAS number of 4-(2-羧基乙烯基)苯甲酸甲酯 is 19473-96-2.
What is the molecular formula of 4-(2-羧基乙烯基)苯甲酸甲酯?
The molecular formula of 4-(2-羧基乙烯基)苯甲酸甲酯 is C11H10O4.
What is the molecular weight of 4-(2-羧基乙烯基)苯甲酸甲酯?
The molecular weight of 4-(2-羧基乙烯基)苯甲酸甲酯 is 206.06 g/mol.
Where can I buy 4-(2-羧基乙烯基)苯甲酸甲酯?
You can request a quote for 4-(2-羧基乙烯基)苯甲酸甲酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-羧基乙烯基)苯甲酸甲酯?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-羧基乙烯基)苯甲酸甲酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.