EINECS 250-129-3
TL;DR: EINECS 250-129-3 (CAS 30320-26-4) is a chemical compound with molecular formula C9F18 and molecular weight 449.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,1,4,4,5,5,5-octafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-(trifluoromethyl)pent-2-ene
Also Known As: Perfluoro-3-ethyl-2,4-dimethyl-2-pentene, 1,1,1,4,5,5,5-Heptafluoro-3-(pentafluoroethyl)-2,4-bis(trifluoromethyl)pent-2-ene, perfluoro-2,4-dimethyl-3-ethyl-2-pentene, perfluoro(3-ethyl-2,4-dimethyl-2-pentene), 1,1,1,4,4,5,5,5-octafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-(trifluoromethyl)pent-2-ene
| Molecular Formula | C9F18 |
|---|---|
| Molecular Weight | 449.97 g/mol |
| LogP | 7.0 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 2 |
| Exact Mass | 449.97125 |
| Heavy Atoms | 27 |
| Complexity | 540.0 |
Chemical Identifiers
| CAS Number | 30320-26-4 |
|---|---|
| SMILES | C(=C(C(F)(F)F)C(F)(F)F)(C(C(F)(F)F)(C(F)(F)F)F)C(C(F)(F)F)(F)F |
| InChIKey | KJIGYKCIAQBHEL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
EINECS 250-129-3 (CAS 30320-26-4), with molecular formula C9F18 and molecular weight 449.97 g/mol. IUPAC: 1,1,1,4,4,5,5,5-octafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-(trifluoromethyl)pent-2-ene.
Chemical Property Profile of EINECS 250-129-3
Property Insights of EINECS 250-129-3
The XLogP value of 7.0 indicates that EINECS 250-129-3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, EINECS 250-129-3 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, EINECS 250-129-3 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 EINECS 250-129-3?
The CAS number of EINECS 250-129-3 is 30320-26-4.
What is the molecular formula of EINECS 250-129-3?
The molecular formula of EINECS 250-129-3 is C9F18.
What is the molecular weight of EINECS 250-129-3?
The molecular weight of EINECS 250-129-3 is 449.97 g/mol.
Where can I buy EINECS 250-129-3?
You can request a quote for EINECS 250-129-3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 250-129-3?
Yes, KEHONG BIO provides custom synthesis services for EINECS 250-129-3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.