Carolic acid
TL;DR: Carolic acid (CAS 22981-79-9) is a chemical compound with molecular formula C9H10O4 and molecular weight 182.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Carolic acid
(3E,5R)-5-methyl-3-(oxolan-2-ylidene)oxolane-2,4-dione
Also Known As: Carolic acid, (+)-Carolicacid, (R)-Carolic acid, (3E,5R)-5-methyl-3-(oxolan-2-ylidene)oxolane-2,4-dione, (R)-3-(Tetrahydrofuran-2-ylidene)-5-methylfuran-2,4(3H,5H)-dione
| Molecular Formula | C9H10O4 |
|---|---|
| Molecular Weight | 182.06 g/mol |
| LogP | 0.5653 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 182.0579 |
| Heavy Atoms | 13 |
| Complexity | 294.73657 |
Chemical Identifiers
| CAS Number | 22981-79-9 |
|---|---|
| SMILES | C[C@@H]1C(=O)/C(=C\2/CCCO2)/C(=O)O1 |
Product Overview
Carolic acid (CAS 22981-79-9), with molecular formula C9H10O4 and molecular weight 182.06 g/mol. IUPAC: (3E,5R)-5-methyl-3-(oxolan-2-ylidene)oxolane-2,4-dione.
Chemical Property Profile of Carolic acid
Property Insights of Carolic acid
The XLogP value of 0.5653 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carolic acid. With a topological polar surface area (TPSA) of 52.6 Ų, Carolic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carolic acid 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 Carolic acid?
The CAS number of Carolic acid is 22981-79-9.
What is the molecular formula of Carolic acid?
The molecular formula of Carolic acid is C9H10O4.
What is the molecular weight of Carolic acid?
The molecular weight of Carolic acid is 182.06 g/mol.
Where can I buy Carolic acid?
You can request a quote for Carolic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carolic acid?
Yes, KEHONG BIO provides custom synthesis services for Carolic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.