Avarol C
TL;DR: Avarol C (CAS 130203-69-9) is a chemical compound with molecular formula C23H32O4 and molecular weight 372.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[[(1R,2S,4aS,8aS)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]methyl]-3,6-dihydroxyphenyl] acetate
Also Known As: Avarol C, Avarone C, 6'-Acetoxyavarol, 1,2,4-Benzenetriol, 3-((1,2,3,4,4a,7,8,8a-octahydro-1,2,4a,5-tetramethyl-1-naphthalenyl)methyl)-, 2-acetate, (1R-(1alpha,2beta,4alphabeta,8aalpha))-, [2-[[(1R,2S,4aS,8aS)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]methyl]-3,6-dihydroxy-phenyl] acetate
| Molecular Formula | C23H32O4 |
|---|---|
| Molecular Weight | 372.23 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 372.23007 |
| Heavy Atoms | 27 |
| Complexity | 599.0 |
Chemical Identifiers
| CAS Number | 130203-69-9 |
|---|---|
| SMILES | C[C@H]1CC[C@]2([C@H]([C@]1(C)CC3=C(C=CC(=C3OC(=O)C)O)O)CCC=C2C)C |
| InChIKey | QALBXSHCQOFDPS-APQCTARYSA-N |
Product Overview
Avarol C (CAS 130203-69-9), with molecular formula C23H32O4 and molecular weight 372.23 g/mol. IUPAC: [2-[[(1R,2S,4aS,8aS)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]methyl]-3,6-dihydroxyphenyl] acetate.
Chemical Property Profile of Avarol C
Property Insights of Avarol C
The XLogP value of 5.7 indicates that Avarol C is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Avarol C. Following Lipinski's Rule of Five, Avarol C has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Avarol C?
The CAS number of Avarol C is 130203-69-9.
What is the molecular formula of Avarol C?
The molecular formula of Avarol C is C23H32O4.
What is the molecular weight of Avarol C?
The molecular weight of Avarol C is 372.23 g/mol.
Where can I buy Avarol C?
You can request a quote for Avarol C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Avarol C?
Yes, KEHONG BIO provides custom synthesis services for Avarol C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.