3-(perfluorodecyl)propionitrile
TL;DR: 3-(perfluorodecyl)propionitrile (CAS 140834-59-9) is a chemical compound with molecular formula C13H4F21N and molecular weight 573.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,13-henicosafluorotridecanenitrile
Also Known As: 3-(perfluorodecyl)propionitrile, 4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,13-henicosafluorotridecanenitrile, RefChem:284768
| Molecular Formula | C13H4F21N |
|---|---|
| Molecular Weight | 573.00 g/mol |
| LogP | 7.57018 |
| Topological Polar Surface Area | 23.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 10 |
| Exact Mass | 573.00085 |
| Heavy Atoms | 35 |
| Complexity | 812.0559 |
Chemical Identifiers
| CAS Number | 140834-59-9 |
|---|---|
| SMILES | C(CC(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C#N |
Product Overview
3-(perfluorodecyl)propionitrile (CAS 140834-59-9), with molecular formula C13H4F21N and molecular weight 573.00 g/mol. IUPAC: 4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,13-henicosafluorotridecanenitrile.
Chemical Property Profile of 3-(perfluorodecyl)propionitrile
Property Insights of 3-(perfluorodecyl)propionitrile
The XLogP value of 7.57018 indicates that 3-(perfluorodecyl)propionitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.79 Ų, 3-(perfluorodecyl)propionitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(perfluorodecyl)propionitrile has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(perfluorodecyl)propionitrile?
The CAS number of 3-(perfluorodecyl)propionitrile is 140834-59-9.
What is the molecular formula of 3-(perfluorodecyl)propionitrile?
The molecular formula of 3-(perfluorodecyl)propionitrile is C13H4F21N.
What is the molecular weight of 3-(perfluorodecyl)propionitrile?
The molecular weight of 3-(perfluorodecyl)propionitrile is 573.00 g/mol.
Where can I buy 3-(perfluorodecyl)propionitrile?
You can request a quote for 3-(perfluorodecyl)propionitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(perfluorodecyl)propionitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-(perfluorodecyl)propionitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.