Demethylphytylplastoquinone
TL;DR: Demethylphytylplastoquinone (CAS 76448-36-7) is a chemical compound with molecular formula C27H44O2 and molecular weight 400.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-3-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]cyclohexa-2,5-diene-1,4-dione
Also Known As: 3-Phytyltoluquinone, 2-Methyl-3-phytylbenzoquinone, Demethylphytylplastoquinone, methylphytylbenzoquinone, 2-Methyl-6-phytylbenzoquinone
| Molecular Formula | C27H44O2 |
|---|---|
| Molecular Weight | 400.33 g/mol |
| LogP | 7.7864 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 14 |
| Exact Mass | 400.33414 |
| Heavy Atoms | 29 |
| Complexity | 618.44904 |
Chemical Identifiers
| CAS Number | 76448-36-7 |
|---|---|
| SMILES | CC1=C(C(=O)C=CC1=O)C/C=C(\C)/CCC[C@H](C)CCC[C@H](C)CCCC(C)C |
Product Overview
Demethylphytylplastoquinone (CAS 76448-36-7), with molecular formula C27H44O2 and molecular weight 400.33 g/mol. IUPAC: 2-methyl-3-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]cyclohexa-2,5-diene-1,4-dione.
Chemical Property Profile of Demethylphytylplastoquinone
Property Insights of Demethylphytylplastoquinone
The XLogP value of 7.7864 indicates that Demethylphytylplastoquinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, Demethylphytylplastoquinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Demethylphytylplastoquinone has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Demethylphytylplastoquinone?
The CAS number of Demethylphytylplastoquinone is 76448-36-7.
What is the molecular formula of Demethylphytylplastoquinone?
The molecular formula of Demethylphytylplastoquinone is C27H44O2.
What is the molecular weight of Demethylphytylplastoquinone?
The molecular weight of Demethylphytylplastoquinone is 400.33 g/mol.
Where can I buy Demethylphytylplastoquinone?
You can request a quote for Demethylphytylplastoquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Demethylphytylplastoquinone?
Yes, KEHONG BIO provides custom synthesis services for Demethylphytylplastoquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.