Ocimarin
TL;DR: Ocimarin (CAS 10185-02-1) is a chemical compound with molecular formula C12H12O4 and molecular weight 220.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-hydroxy-3-(2-hydroxyethyl)-4-methylchromen-2-one
Also Known As: ocimarin, 7-hydroxy-3-(2-hydroxyethyl)-4-methyl-2H-chromen-2-one, 7-HYDROXY-4-METHYL-3-(2-HYDROXY-ETHYL)COUMARIN, 7-hydroxy-3-(2-hydroxyethyl)-4-methylchromen-2-one, J2.517.894G
| Molecular Formula | C12H12O4 |
|---|---|
| Molecular Weight | 220.07 g/mol |
| LogP | 1.34182 |
| Topological Polar Surface Area | 70.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 220.07356 |
| Heavy Atoms | 16 |
| Complexity | 583.32385 |
Chemical Identifiers
| CAS Number | 10185-02-1 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=C1C=CC(=C2)O)CCO |
Product Overview
Ocimarin (CAS 10185-02-1), with molecular formula C12H12O4 and molecular weight 220.07 g/mol. IUPAC: 7-hydroxy-3-(2-hydroxyethyl)-4-methylchromen-2-one.
Chemical Property Profile of Ocimarin
Property Insights of Ocimarin
The XLogP value of 1.34182 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ocimarin. The TPSA of 70.67 Ų falls within the moderate polarity range, balancing permeability and solubility for Ocimarin. Following Lipinski's Rule of Five, Ocimarin 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 Ocimarin?
The CAS number of Ocimarin is 10185-02-1.
What is the molecular formula of Ocimarin?
The molecular formula of Ocimarin is C12H12O4.
What is the molecular weight of Ocimarin?
The molecular weight of Ocimarin is 220.07 g/mol.
Where can I buy Ocimarin?
You can request a quote for Ocimarin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ocimarin?
Yes, KEHONG BIO provides custom synthesis services for Ocimarin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.