5-Oxo-2-phenyloxolane-3-carboxylic acid
TL;DR: 5-Oxo-2-phenyloxolane-3-carboxylic acid (CAS 13389-88-3) 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.
5-Oxo-2-phenyloxolane-3-carboxylic acid
5-oxo-2-phenyloxolane-3-carboxylic acid
Also Known As: 5-oxo-2-phenyloxolane-3-carboxylic acid, 5-Oxo-2-phenyl-tetrahydro-furan-3-carboxylic acid, 5-Oxo-2-phenyltetrahydrofuran-3-carboxylic acid, 2-Bromo-3-chloro-1-propene, 3845AD
| Molecular Formula | C11H10O4 |
|---|---|
| Molecular Weight | 206.06 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.0579 |
| Heavy Atoms | 15 |
| Complexity | 268.0 |
Chemical Identifiers
| CAS Number | 13389-88-3 |
|---|---|
| SMILES | C1C(C(OC1=O)C2=CC=CC=C2)C(=O)O |
| InChIKey | LRMTVZBRYDTDCU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Oxo-2-phenyloxolane-3-carboxylic acid (CAS 13389-88-3), with molecular formula C11H10O4 and molecular weight 206.06 g/mol. IUPAC: 5-oxo-2-phenyloxolane-3-carboxylic acid.
Chemical Property Profile of 5-Oxo-2-phenyloxolane-3-carboxylic acid
Property Insights of 5-Oxo-2-phenyloxolane-3-carboxylic acid
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Oxo-2-phenyloxolane-3-carboxylic acid. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Oxo-2-phenyloxolane-3-carboxylic acid. Following Lipinski's Rule of Five, 5-氧代-2-苯基氧杂环戊烷-3-甲酸 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 5-氧代-2-苯基氧杂环戊烷-3-甲酸?
The CAS number of 5-氧代-2-苯基氧杂环戊烷-3-甲酸 is 13389-88-3.
What is the molecular formula of 5-氧代-2-苯基氧杂环戊烷-3-甲酸?
The molecular formula of 5-氧代-2-苯基氧杂环戊烷-3-甲酸 is C11H10O4.
What is the molecular weight of 5-氧代-2-苯基氧杂环戊烷-3-甲酸?
The molecular weight of 5-氧代-2-苯基氧杂环戊烷-3-甲酸 is 206.06 g/mol.
Where can I buy 5-氧代-2-苯基氧杂环戊烷-3-甲酸?
You can request a quote for 5-氧代-2-苯基氧杂环戊烷-3-甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-氧代-2-苯基氧杂环戊烷-3-甲酸?
Yes, KEHONG BIO provides custom synthesis services for 5-氧代-2-苯基氧杂环戊烷-3-甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.