2-Trifluoromethyl-3-geranyl-1,4-naphthoquinone
TL;DR: 2-Trifluoromethyl-3-geranyl-1,4-naphthoquinone (CAS 119053-70-2) is a chemical compound with molecular formula C21H21F3O2 and molecular weight 362.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2E)-3,7-dimethylocta-2,6-dienyl]-3-(trifluoromethyl)naphthalene-1,4-dione
Also Known As: 2-Trifluoromethylmenaquinone, 2-Trifluoromethyl-3-geranyl-1,4-naphthoquinone, 2-azido-N-(2,6-dimethylphenyl)acetamide, 2-[(2E)-3,7-dimethylocta-2,6-dienyl]-3-(trifluoromethyl)naphthalene-1,4-dione, 2-(3,7-dimethylocta-2,6-dienyl)-3-(trifluoromethyl)naphthalene-1,4-dione
| Molecular Formula | C21H21F3O2 |
|---|---|
| Molecular Weight | 362.15 g/mol |
| LogP | 6.0073 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 362.14935 |
| Heavy Atoms | 26 |
| Complexity | 819.9031 |
Chemical Identifiers
| CAS Number | 119053-70-2 |
|---|---|
| SMILES | CC(=CCC/C(=C/CC1=C(C(=O)C2=CC=CC=C2C1=O)C(F)(F)F)/C)C |
Product Overview
2-Trifluoromethyl-3-geranyl-1,4-naphthoquinone (CAS 119053-70-2), with molecular formula C21H21F3O2 and molecular weight 362.15 g/mol. IUPAC: 2-[(2E)-3,7-dimethylocta-2,6-dienyl]-3-(trifluoromethyl)naphthalene-1,4-dione.
Chemical Property Profile of 2-Trifluoromethyl-3-geranyl-1,4-naphthoquinone
Property Insights of 2-Trifluoromethyl-3-geranyl-1,4-naphthoquinone
The XLogP value of 6.0073 indicates that 2-Trifluoromethyl-3-geranyl-1,4-naphthoquinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, 2-Trifluoromethyl-3-geranyl-1,4-naphthoquinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Trifluoromethyl-3-geranyl-1,4-naphthoquinone 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 2-Trifluoromethyl-3-geranyl-1,4-naphthoquinone?
The CAS number of 2-Trifluoromethyl-3-geranyl-1,4-naphthoquinone is 119053-70-2.
What is the molecular formula of 2-Trifluoromethyl-3-geranyl-1,4-naphthoquinone?
The molecular formula of 2-Trifluoromethyl-3-geranyl-1,4-naphthoquinone is C21H21F3O2.
What is the molecular weight of 2-Trifluoromethyl-3-geranyl-1,4-naphthoquinone?
The molecular weight of 2-Trifluoromethyl-3-geranyl-1,4-naphthoquinone is 362.15 g/mol.
Where can I buy 2-Trifluoromethyl-3-geranyl-1,4-naphthoquinone?
You can request a quote for 2-Trifluoromethyl-3-geranyl-1,4-naphthoquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Trifluoromethyl-3-geranyl-1,4-naphthoquinone?
Yes, KEHONG BIO provides custom synthesis services for 2-Trifluoromethyl-3-geranyl-1,4-naphthoquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.