8-((2,4-Dimethyl-1-nitrilopent-2-yl)dioxy)tocopherone
TL;DR: 8-((2,4-Dimethyl-1-nitrilopent-2-yl)dioxy)tocopherone (CAS 123438-35-7) is a chemical compound with molecular formula C40H67NO4 and molecular weight 625.51 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dimethyl-2-[[2,5,7,8-tetramethyl-6-oxo-2-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]-3,4-dihydrochromen-8a-yl]peroxy]pentanenitrile
Also Known As: 8a-Dnpdt, 8-((2,4-Dimethyl-1-nitrilopent-2-yl)dioxy)tocopherone, 2,4-dimethyl-2-[[2,5,7,8-tetramethyl-6-oxo-2-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]-3,4-dihydrochromen-8a-yl]peroxy]pentanenitrile, Pentanenitrile, 2,4-dimethyl-2-((2,3,4,6-tetrahydro-2,5,7,8-tetramethyl-6-oxo-2-(3,7,11,15-tetramethyl-2-hexadecenyl)-8aH-2-benzopyran-8a-yl)dioxy)-, RefChem:106786
| Molecular Formula | C40H67NO4 |
|---|---|
| Molecular Weight | 625.51 g/mol |
| LogP | 11.53948 |
| Topological Polar Surface Area | 68.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 19 |
| Exact Mass | 625.507 |
| Heavy Atoms | 45 |
| Complexity | 1123.6064 |
Chemical Identifiers
| CAS Number | 123438-35-7 |
|---|---|
| SMILES | CC1=C(C2(C(=C(C1=O)C)CCC(O2)(C)C/C=C(\C)/CCCC(C)CCCC(C)CCCC(C)C)OOC(C)(CC(C)C)C#N)C |
Product Overview
8-((2,4-Dimethyl-1-nitrilopent-2-yl)dioxy)tocopherone (CAS 123438-35-7), with molecular formula C40H67NO4 and molecular weight 625.51 g/mol. IUPAC: 2,4-dimethyl-2-[[2,5,7,8-tetramethyl-6-oxo-2-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]-3,4-dihydrochromen-8a-yl]peroxy]pentanenitrile.
Chemical Property Profile of 8-((2,4-Dimethyl-1-nitrilopent-2-yl)dioxy)tocopherone
Property Insights of 8-((2,4-Dimethyl-1-nitrilopent-2-yl)dioxy)tocopherone
The XLogP value of 11.53948 indicates that 8-((2,4-Dimethyl-1-nitrilopent-2-yl)dioxy)tocopherone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-((2,4-Dimethyl-1-nitrilopent-2-yl)dioxy)tocopherone. Following Lipinski's Rule of Five, 8-((2,4-Dimethyl-1-nitrilopent-2-yl)dioxy)tocopherone has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 8-((2,4-Dimethyl-1-nitrilopent-2-yl)dioxy)tocopherone?
The CAS number of 8-((2,4-Dimethyl-1-nitrilopent-2-yl)dioxy)tocopherone is 123438-35-7.
What is the molecular formula of 8-((2,4-Dimethyl-1-nitrilopent-2-yl)dioxy)tocopherone?
The molecular formula of 8-((2,4-Dimethyl-1-nitrilopent-2-yl)dioxy)tocopherone is C40H67NO4.
What is the molecular weight of 8-((2,4-Dimethyl-1-nitrilopent-2-yl)dioxy)tocopherone?
The molecular weight of 8-((2,4-Dimethyl-1-nitrilopent-2-yl)dioxy)tocopherone is 625.51 g/mol.
Where can I buy 8-((2,4-Dimethyl-1-nitrilopent-2-yl)dioxy)tocopherone?
You can request a quote for 8-((2,4-Dimethyl-1-nitrilopent-2-yl)dioxy)tocopherone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-((2,4-Dimethyl-1-nitrilopent-2-yl)dioxy)tocopherone?
Yes, KEHONG BIO provides custom synthesis services for 8-((2,4-Dimethyl-1-nitrilopent-2-yl)dioxy)tocopherone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.