2-NONENAL, 4-HYDROPEROXY-
TL;DR: 2-NONENAL, 4-HYDROPEROXY- (CAS 83920-72-3) is a chemical compound with molecular formula C30H42O6 and molecular weight 498.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1,6-dihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-5-oxo-13-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] (2E,4E)-deca-2,4-dienoate
Also Known As: 2-NONENAL, 4-HYDROPEROXY-, 2,4-Decadienoic acid, 1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-9aH-cyclopropa(3,4)benz(1,2-e)azulen-9a-yl ester, (1aR-(1aalpha,1bbeta,4abeta,7aalpha,7balpha,8alpha,9aalpha))-
| Molecular Formula | C30H42O6 |
|---|---|
| Molecular Weight | 498.30 g/mol |
| LogP | 4.2029 |
| Topological Polar Surface Area | 104.06 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 498.29813 |
| Heavy Atoms | 36 |
| Complexity | 1034.0393 |
Chemical Identifiers
| CAS Number | 83920-72-3 |
|---|---|
| SMILES | CCCCC/C=C/C=C/C(=O)OC12CC(C3(C(C1C2(C)C)C=C(CC4(C3C=C(C4=O)C)O)CO)O)C |
Product Overview
2-NONENAL, 4-HYDROPEROXY- (CAS 83920-72-3), with molecular formula C30H42O6 and molecular weight 498.30 g/mol. IUPAC: [1,6-dihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-5-oxo-13-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] (2E,4E)-deca-2,4-dienoate.
Chemical Property Profile of 2-NONENAL, 4-HYDROPEROXY-
Property Insights of 2-NONENAL, 4-HYDROPEROXY-
The XLogP value of 4.2029 indicates that 2-NONENAL, 4-HYDROPEROXY- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-NONENAL, 4-HYDROPEROXY-. Following Lipinski's Rule of Five, 2-NONENAL, 4-HYDROPEROXY- has 3 hydrogen bond donor(s) and 6 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 2-NONENAL, 4-HYDROPEROXY-?
The CAS number of 2-NONENAL, 4-HYDROPEROXY- is 83920-72-3.
What is the molecular formula of 2-NONENAL, 4-HYDROPEROXY-?
The molecular formula of 2-NONENAL, 4-HYDROPEROXY- is C30H42O6.
What is the molecular weight of 2-NONENAL, 4-HYDROPEROXY-?
The molecular weight of 2-NONENAL, 4-HYDROPEROXY- is 498.30 g/mol.
Where can I buy 2-NONENAL, 4-HYDROPEROXY-?
You can request a quote for 2-NONENAL, 4-HYDROPEROXY- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-NONENAL, 4-HYDROPEROXY-?
Yes, KEHONG BIO provides custom synthesis services for 2-NONENAL, 4-HYDROPEROXY- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.