5-Hexyn-1-ol
TL;DR: 5-Hexyn-1-ol (CAS 2355-57-9) is a chemical compound with molecular formula C24H20F24O4 and molecular weight 828.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl) 1,2,2-trimethylcyclopentane-1,3-dicarboxylate
Also Known As: 5-Hexyn-1-ol, BIS DICAMPHORATE, BIS(1H,1H,7H-PERFLUOROHEPTYL)DICAMPHORATE, Bis(2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl) 1,2,2-trimethylcyclopentane-1,3-dicarboxylate, Bis-(1H,1H,7H-perfluoroheptyl) (1S,3R)-camphorate
| Molecular Formula | C24H20F24O4 |
|---|---|
| Molecular Weight | 828.10 g/mol |
| LogP | 9.3985 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 16 |
| Exact Mass | 828.09784 |
| Heavy Atoms | 52 |
| Complexity | 1324.9573 |
Chemical Identifiers
| CAS Number | 2355-57-9 |
|---|---|
| SMILES | CC1(C(CCC1(C)C(=O)OCC(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(=O)OCC(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C |
Product Overview
5-Hexyn-1-ol (CAS 2355-57-9), with molecular formula C24H20F24O4 and molecular weight 828.10 g/mol. IUPAC: bis(2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl) 1,2,2-trimethylcyclopentane-1,3-dicarboxylate.
Chemical Property Profile of 5-Hexyn-1-ol
Property Insights of 5-Hexyn-1-ol
The XLogP value of 9.3985 indicates that 5-Hexyn-1-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 5-Hexyn-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Hexyn-1-ol has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-Hexyn-1-ol?
The CAS number of 5-Hexyn-1-ol is 2355-57-9.
What is the molecular formula of 5-Hexyn-1-ol?
The molecular formula of 5-Hexyn-1-ol is C24H20F24O4.
What is the molecular weight of 5-Hexyn-1-ol?
The molecular weight of 5-Hexyn-1-ol is 828.10 g/mol.
Where can I buy 5-Hexyn-1-ol?
You can request a quote for 5-Hexyn-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Hexyn-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 5-Hexyn-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.