3-(2-乙酰氧基苯基)丙-2-烯酸
TL;DR: 3-(2-乙酰氧基苯基)丙-2-烯酸 (CAS 55620-18-3) 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.
3-(2-乙酰氧基苯基)丙-2-烯酸
3-(2-acetyloxyphenyl)prop-2-enoic acid
Also Known As: 2-Acetoxycinnamic acid, Tylmarin, 2-Acetylcoumaric acid, o-Acetoxycinnamic acid, 2-Acetpxycinnamic acid
| Molecular Formula | C11H10O4 |
|---|---|
| Molecular Weight | 206.06 g/mol |
| LogP | 1.6 |
| 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 | 270.0 |
Chemical Identifiers
| CAS Number | 55620-18-3 |
|---|---|
| SMILES | CC(=O)OC1=CC=CC=C1C=CC(=O)O |
| InChIKey | UXOWQQCLBQBRMQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(2-乙酰氧基苯基)丙-2-烯酸 (CAS 55620-18-3), with molecular formula C11H10O4 and molecular weight 206.06 g/mol. IUPAC: 3-(2-acetyloxyphenyl)prop-2-enoic acid.
Chemical Property Profile of 3-(2-乙酰氧基苯基)丙-2-烯酸
Property Insights of 3-(2-乙酰氧基苯基)丙-2-烯酸
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-乙酰氧基苯基)丙-2-烯酸. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-乙酰氧基苯基)丙-2-烯酸. Following Lipinski's Rule of Five, 3-(2-乙酰氧基苯基)丙-2-烯酸 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 3-(2-乙酰氧基苯基)丙-2-烯酸?
The CAS number of 3-(2-乙酰氧基苯基)丙-2-烯酸 is 55620-18-3.
What is the molecular formula of 3-(2-乙酰氧基苯基)丙-2-烯酸?
The molecular formula of 3-(2-乙酰氧基苯基)丙-2-烯酸 is C11H10O4.
What is the molecular weight of 3-(2-乙酰氧基苯基)丙-2-烯酸?
The molecular weight of 3-(2-乙酰氧基苯基)丙-2-烯酸 is 206.06 g/mol.
Where can I buy 3-(2-乙酰氧基苯基)丙-2-烯酸?
You can request a quote for 3-(2-乙酰氧基苯基)丙-2-烯酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-乙酰氧基苯基)丙-2-烯酸?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-乙酰氧基苯基)丙-2-烯酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.