Benzene, ethylpentafluoro-
TL;DR: Benzene, ethylpentafluoro- (CAS 2251-81-2) is a chemical compound with molecular formula C8H5F5 and molecular weight 196.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-2,3,4,5,6-pentafluorobenzene
Also Known As: Benzene, ethylpentafluoro-, Ethylpentafluorobenzene, 1-Ethyl-2,3,4,5,6-pentafluorobenzene, 2,3,4,5,6-Pentafluoroethylbenzene, Benzene, 1-ethyl-2,3,4,5,6-pentafluoro-
| Molecular Formula | C8H5F5 |
|---|---|
| Molecular Weight | 196.03 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 196.03114 |
| Heavy Atoms | 13 |
| Complexity | 158.0 |
Chemical Identifiers
| CAS Number | 2251-81-2 |
|---|---|
| SMILES | CCC1=C(C(=C(C(=C1F)F)F)F)F |
| InChIKey | NBOXZRBYWXQDLY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzene, ethylpentafluoro- (CAS 2251-81-2), with molecular formula C8H5F5 and molecular weight 196.03 g/mol. IUPAC: 1-ethyl-2,3,4,5,6-pentafluorobenzene.
Chemical Property Profile of Benzene, ethylpentafluoro-
Property Insights of Benzene, ethylpentafluoro-
The XLogP value of 3.2 indicates that Benzene, ethylpentafluoro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Benzene, ethylpentafluoro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, ethylpentafluoro- has 0 hydrogen bond donor(s) and 5 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 Benzene, ethylpentafluoro-?
The CAS number of Benzene, ethylpentafluoro- is 2251-81-2.
What is the molecular formula of Benzene, ethylpentafluoro-?
The molecular formula of Benzene, ethylpentafluoro- is C8H5F5.
What is the molecular weight of Benzene, ethylpentafluoro-?
The molecular weight of Benzene, ethylpentafluoro- is 196.03 g/mol.
Where can I buy Benzene, ethylpentafluoro-?
You can request a quote for Benzene, ethylpentafluoro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, ethylpentafluoro-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, ethylpentafluoro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.