Perfluorohexamethyl dewar benzene
TL;DR: Perfluorohexamethyl dewar benzene (CAS 23174-55-2) is a chemical compound with molecular formula C12F18 and molecular weight 485.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4,5,6-hexakis(trifluoromethyl)bicyclo[2.2.0]hexa-2,5-diene
Also Known As: Perfluorohexamethyl dewar benzene, Hexakis(trifluoromethyl)Dewar benzene, hexakis(trifluoro-methyl)bicyclo[2.2.0]hexa-2,5-diene, hexakis(trifluoromethyl)bicyclo[2.2.0]hexa-2,5-diene, 1,2,3,4,5,6-hexakis(trifluoromethyl)bicyclo[2.2.0]hexa-2,5-diene
| Molecular Formula | C12F18 |
|---|---|
| Molecular Weight | 485.97 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 0 |
| Exact Mass | 485.97125 |
| Heavy Atoms | 30 |
| Complexity | 692.0 |
Chemical Identifiers
| CAS Number | 23174-55-2 |
|---|---|
| SMILES | C1(=C(C2(C1(C(=C2C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F |
| InChIKey | UHFLOEPBRVWBKP-UHFFFAOYSA-N |
Product Overview
Perfluorohexamethyl dewar benzene (CAS 23174-55-2), with molecular formula C12F18 and molecular weight 485.97 g/mol. IUPAC: 1,2,3,4,5,6-hexakis(trifluoromethyl)bicyclo[2.2.0]hexa-2,5-diene.
Chemical Property Profile of Perfluorohexamethyl dewar benzene
Property Insights of Perfluorohexamethyl dewar benzene
The XLogP value of 5.5 indicates that Perfluorohexamethyl dewar benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Perfluorohexamethyl dewar benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Perfluorohexamethyl dewar benzene has 0 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Perfluorohexamethyl dewar benzene?
The CAS number of Perfluorohexamethyl dewar benzene is 23174-55-2.
What is the molecular formula of Perfluorohexamethyl dewar benzene?
The molecular formula of Perfluorohexamethyl dewar benzene is C12F18.
What is the molecular weight of Perfluorohexamethyl dewar benzene?
The molecular weight of Perfluorohexamethyl dewar benzene is 485.97 g/mol.
Where can I buy Perfluorohexamethyl dewar benzene?
You can request a quote for Perfluorohexamethyl dewar benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Perfluorohexamethyl dewar benzene?
Yes, KEHONG BIO provides custom synthesis services for Perfluorohexamethyl dewar benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.