Butyl 2,2,3,3,4,4,4-heptafluorobutanoate
TL;DR: Butyl 2,2,3,3,4,4,4-heptafluorobutanoate (CAS 1559-07-5) is a chemical compound with molecular formula C8H9F7O2 and molecular weight 270.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 2,2,3,3,4,4,4-heptafluorobutanoate
Also Known As: n-BUTYL HEPTAFLUOROBUTYRATE, Butyl heptafluorobutanoate, Butyl 2,2,3,3,4,4,4-heptafluorobutanoate, Butyl perfluorobutanoate, n-Butylheptafluorobutyrate
| Molecular Formula | C8H9F7O2 |
|---|---|
| Molecular Weight | 270.05 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 270.04907 |
| Heavy Atoms | 17 |
| Complexity | 272.0 |
Chemical Identifiers
| CAS Number | 1559-07-5 |
|---|---|
| SMILES | CCCCOC(=O)C(C(C(F)(F)F)(F)F)(F)F |
| InChIKey | YDXXJZKOOOJVEE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butyl 2,2,3,3,4,4,4-heptafluorobutanoate (CAS 1559-07-5), with molecular formula C8H9F7O2 and molecular weight 270.05 g/mol. IUPAC: butyl 2,2,3,3,4,4,4-heptafluorobutanoate.
Chemical Property Profile of Butyl 2,2,3,3,4,4,4-heptafluorobutanoate
Property Insights of Butyl 2,2,3,3,4,4,4-heptafluorobutanoate
The XLogP value of 3.8 indicates that Butyl 2,2,3,3,4,4,4-heptafluorobutanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Butyl 2,2,3,3,4,4,4-heptafluorobutanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl 2,2,3,3,4,4,4-heptafluorobutanoate has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Butyl 2,2,3,3,4,4,4-heptafluorobutanoate?
The CAS number of Butyl 2,2,3,3,4,4,4-heptafluorobutanoate is 1559-07-5.
What is the molecular formula of Butyl 2,2,3,3,4,4,4-heptafluorobutanoate?
The molecular formula of Butyl 2,2,3,3,4,4,4-heptafluorobutanoate is C8H9F7O2.
What is the molecular weight of Butyl 2,2,3,3,4,4,4-heptafluorobutanoate?
The molecular weight of Butyl 2,2,3,3,4,4,4-heptafluorobutanoate is 270.05 g/mol.
Where can I buy Butyl 2,2,3,3,4,4,4-heptafluorobutanoate?
You can request a quote for Butyl 2,2,3,3,4,4,4-heptafluorobutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl 2,2,3,3,4,4,4-heptafluorobutanoate?
Yes, KEHONG BIO provides custom synthesis services for Butyl 2,2,3,3,4,4,4-heptafluorobutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.