3-Heptene-2,6-diol,1,1,1,7,7,7-hexafluoro-2,6-bis(trifluoromethyl)-, (3e)-
TL;DR: 3-Heptene-2,6-diol,1,1,1,7,7,7-hexafluoro-2,6-bis(trifluoromethyl)-, (3e)- (CAS 16202-99-6) is a chemical compound with molecular formula C9H6F12O2 and molecular weight 374.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,1,7,7,7-hexafluoro-2,6-bis(trifluoromethyl)hept-3-ene-2,6-diol
Also Known As: 1,1,1,7,7,7-Hexafluoro-2,6-bis(trifluoromethyl)hept-3-ene-2,6-diol, 3-Heptene-2,6-diol,1,1,1,7,7,7-hexafluoro-2,6-bis(trifluoromethyl)-, (3e)-, 3-Heptene-2,6-diol,1,1,1,7,7,7-hexafluoro-2,6-bis(trifluoromethyl)-, 1,1,1,7,7,7-HEXAFLUORO-2,6-BIS(TRIFLUOROMETHYL)-3-HEPTENE-2,6-DIOL, 3-Heptene-2,6-diol,1,1,1,7,7,7-hexafluoro-2,6-bis(trifluoromethyl)-, (3z)-
| Molecular Formula | C9H6F12O2 |
|---|---|
| Molecular Weight | 374.02 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 3 |
| Exact Mass | 374.0176 |
| Heavy Atoms | 23 |
| Complexity | 409.0 |
Chemical Identifiers
| CAS Number | 16202-99-6 |
|---|---|
| SMILES | C(C=CC(C(F)(F)F)(C(F)(F)F)O)C(C(F)(F)F)(C(F)(F)F)O |
| InChIKey | VAKDPITXIDWRMQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Heptene-2,6-diol,1,1,1,7,7,7-hexafluoro-2,6-bis(trifluoromethyl)-, (3e)- (CAS 16202-99-6), with molecular formula C9H6F12O2 and molecular weight 374.02 g/mol. IUPAC: 1,1,1,7,7,7-hexafluoro-2,6-bis(trifluoromethyl)hept-3-ene-2,6-diol.
Chemical Property Profile of 3-Heptene-2,6-diol,1,1,1,7,7,7-hexafluoro-2,6-bis(trifluoromethyl)-, (3e)-
Property Insights of 3-Heptene-2,6-diol,1,1,1,7,7,7-hexafluoro-2,6-bis(trifluoromethyl)-, (3e)-
The XLogP value of 3.8 indicates that 3-Heptene-2,6-diol,1,1,1,7,7,7-hexafluoro-2,6-bis(trifluoromethyl)-, (3e)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 3-Heptene-2,6-diol,1,1,1,7,7,7-hexafluoro-2,6-bis(trifluoromethyl)-, (3e)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Heptene-2,6-diol,1,1,1,7,7,7-hexafluoro-2,6-bis(trifluoromethyl)-, (3e)- has 2 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Heptene-2,6-diol,1,1,1,7,7,7-hexafluoro-2,6-bis(trifluoromethyl)-, (3e)-?
The CAS number of 3-Heptene-2,6-diol,1,1,1,7,7,7-hexafluoro-2,6-bis(trifluoromethyl)-, (3e)- is 16202-99-6.
What is the molecular formula of 3-Heptene-2,6-diol,1,1,1,7,7,7-hexafluoro-2,6-bis(trifluoromethyl)-, (3e)-?
The molecular formula of 3-Heptene-2,6-diol,1,1,1,7,7,7-hexafluoro-2,6-bis(trifluoromethyl)-, (3e)- is C9H6F12O2.
What is the molecular weight of 3-Heptene-2,6-diol,1,1,1,7,7,7-hexafluoro-2,6-bis(trifluoromethyl)-, (3e)-?
The molecular weight of 3-Heptene-2,6-diol,1,1,1,7,7,7-hexafluoro-2,6-bis(trifluoromethyl)-, (3e)- is 374.02 g/mol.
Where can I buy 3-Heptene-2,6-diol,1,1,1,7,7,7-hexafluoro-2,6-bis(trifluoromethyl)-, (3e)-?
You can request a quote for 3-Heptene-2,6-diol,1,1,1,7,7,7-hexafluoro-2,6-bis(trifluoromethyl)-, (3e)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Heptene-2,6-diol,1,1,1,7,7,7-hexafluoro-2,6-bis(trifluoromethyl)-, (3e)-?
Yes, KEHONG BIO provides custom synthesis services for 3-Heptene-2,6-diol,1,1,1,7,7,7-hexafluoro-2,6-bis(trifluoromethyl)-, (3e)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.