蒟蒌酚
TL;DR: 蒟蒌酚 (CAS 501-19-9) is a chemical compound with molecular formula C10H12O2 and molecular weight 164.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
蒟蒌酚
2-methoxy-5-prop-2-enylphenol
Also Known As: Chavibetol, m-Eugenol, 5-Allyl-2-methoxyphenol, meta-Eugenol, 5-Allylguaiacol
| Molecular Formula | C10H12O2 |
|---|---|
| Molecular Weight | 164.08 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 164.08372 |
| Heavy Atoms | 12 |
| Complexity | 145.0 |
Chemical Identifiers
| CAS Number | 501-19-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CC=C)O |
| InChIKey | NPBVQXIMTZKSBA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
蒟蒌酚 (CAS 501-19-9), with molecular formula C10H12O2 and molecular weight 164.08 g/mol. IUPAC: 2-methoxy-5-prop-2-enylphenol.
Chemical Property Profile of 蒟蒌酚
Property Insights of 蒟蒌酚
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 蒟蒌酚. With a topological polar surface area (TPSA) of 29.5 Ų, 蒟蒌酚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 蒟蒌酚 has 1 hydrogen bond donor(s) and 2 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 蒟蒌酚?
The CAS number of 蒟蒌酚 is 501-19-9.
What is the molecular formula of 蒟蒌酚?
The molecular formula of 蒟蒌酚 is C10H12O2.
What is the molecular weight of 蒟蒌酚?
The molecular weight of 蒟蒌酚 is 164.08 g/mol.
Where can I buy 蒟蒌酚?
You can request a quote for 蒟蒌酚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 蒟蒌酚?
Yes, KEHONG BIO provides custom synthesis services for 蒟蒌酚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.