2-(Fluoromethyl)-3-(phytyl)-1,4-naphthoquione 2,3-epoxide
TL;DR: 2-(Fluoromethyl)-3-(phytyl)-1,4-naphthoquione 2,3-epoxide (CAS 122408-83-7) is a chemical compound with molecular formula C31H45FO3 and molecular weight 484.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1a-(fluoromethyl)-7a-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]naphtho[2,3-b]oxirene-2,7-dione
Also Known As: 2-Fmpnqe, 2-(Fluoromethyl)-3-(phytyl)-1,4-naphthoquione 2,3-epoxide, 1a-(fluoromethyl)-7a-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]naphtho[2,3-b]oxirene-2,7-dione, 1a,7a-Dihydro-1a-[(2E)-3,7,11,15-tetramethyl-2-hexadecenyl]-7a-fluoromethylnaphth[2,3-b]oxirene-2,7-dione, 1a-(fluoromethyl)-7a-[(2E)-3,7,11,15-tetramethylhexadec-2-en-1-yl]-1aH,2H,7H,7aH-naphtho[2,3-b]oxirene-2,7-dione
| Molecular Formula | C31H45FO3 |
|---|---|
| Molecular Weight | 484.34 g/mol |
| LogP | 8.3184 |
| Topological Polar Surface Area | 46.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 15 |
| Exact Mass | 484.33527 |
| Heavy Atoms | 35 |
| Complexity | 919.5582 |
Chemical Identifiers
| CAS Number | 122408-83-7 |
|---|---|
| SMILES | CC(C)CCCC(C)CCCC(C)CCC/C(=C/CC12C(=O)C3=CC=CC=C3C(=O)C1(O2)CF)/C |
Product Overview
2-(Fluoromethyl)-3-(phytyl)-1,4-naphthoquione 2,3-epoxide (CAS 122408-83-7), with molecular formula C31H45FO3 and molecular weight 484.34 g/mol. IUPAC: 1a-(fluoromethyl)-7a-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]naphtho[2,3-b]oxirene-2,7-dione.
Chemical Property Profile of 2-(Fluoromethyl)-3-(phytyl)-1,4-naphthoquione 2,3-epoxide
Property Insights of 2-(Fluoromethyl)-3-(phytyl)-1,4-naphthoquione 2,3-epoxide
The XLogP value of 8.3184 indicates that 2-(Fluoromethyl)-3-(phytyl)-1,4-naphthoquione 2,3-epoxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.67 Ų, 2-(Fluoromethyl)-3-(phytyl)-1,4-naphthoquione 2,3-epoxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Fluoromethyl)-3-(phytyl)-1,4-naphthoquione 2,3-epoxide has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(Fluoromethyl)-3-(phytyl)-1,4-naphthoquione 2,3-epoxide?
The CAS number of 2-(Fluoromethyl)-3-(phytyl)-1,4-naphthoquione 2,3-epoxide is 122408-83-7.
What is the molecular formula of 2-(Fluoromethyl)-3-(phytyl)-1,4-naphthoquione 2,3-epoxide?
The molecular formula of 2-(Fluoromethyl)-3-(phytyl)-1,4-naphthoquione 2,3-epoxide is C31H45FO3.
What is the molecular weight of 2-(Fluoromethyl)-3-(phytyl)-1,4-naphthoquione 2,3-epoxide?
The molecular weight of 2-(Fluoromethyl)-3-(phytyl)-1,4-naphthoquione 2,3-epoxide is 484.34 g/mol.
Where can I buy 2-(Fluoromethyl)-3-(phytyl)-1,4-naphthoquione 2,3-epoxide?
You can request a quote for 2-(Fluoromethyl)-3-(phytyl)-1,4-naphthoquione 2,3-epoxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Fluoromethyl)-3-(phytyl)-1,4-naphthoquione 2,3-epoxide?
Yes, KEHONG BIO provides custom synthesis services for 2-(Fluoromethyl)-3-(phytyl)-1,4-naphthoquione 2,3-epoxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.