Benzene, 1-chloro-2,3-difluoro-5-(trifluoromethyl)-
TL;DR: Benzene, 1-chloro-2,3-difluoro-5-(trifluoromethyl)- (CAS 77227-99-7) is a chemical compound with molecular formula C7H2ClF5 and molecular weight 215.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-2,3-difluoro-5-(trifluoromethyl)benzene
Also Known As: 3-Chloro-4,5-difluorobenzotrifluoride, 1-chloro-2,3-difluoro-5-(trifluoromethyl)benzene, 1,1-Dicyclopropylethylene, 2-Bromo-5-iodobenzoic acid, 9535AE
| Molecular Formula | C7H2ClF5 |
|---|---|
| Molecular Weight | 215.98 g/mol |
| LogP | 3.637 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 215.97652 |
| Heavy Atoms | 13 |
| Complexity | 307.14017 |
Chemical Identifiers
| CAS Number | 77227-99-7 |
|---|---|
| SMILES | C1=C(C=C(C(=C1F)F)Cl)C(F)(F)F |
Product Overview
Benzene, 1-chloro-2,3-difluoro-5-(trifluoromethyl)- (CAS 77227-99-7), with molecular formula C7H2ClF5 and molecular weight 215.98 g/mol. IUPAC: 1-chloro-2,3-difluoro-5-(trifluoromethyl)benzene.
Chemical Property Profile of Benzene, 1-chloro-2,3-difluoro-5-(trifluoromethyl)-
Property Insights of Benzene, 1-chloro-2,3-difluoro-5-(trifluoromethyl)-
The XLogP value of 3.637 indicates that Benzene, 1-chloro-2,3-difluoro-5-(trifluoromethyl)- 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, 1-chloro-2,3-difluoro-5-(trifluoromethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1-chloro-2,3-difluoro-5-(trifluoromethyl)- has 0 hydrogen bond donor(s) and 0 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, 1-chloro-2,3-difluoro-5-(trifluoromethyl)-?
The CAS number of Benzene, 1-chloro-2,3-difluoro-5-(trifluoromethyl)- is 77227-99-7.
What is the molecular formula of Benzene, 1-chloro-2,3-difluoro-5-(trifluoromethyl)-?
The molecular formula of Benzene, 1-chloro-2,3-difluoro-5-(trifluoromethyl)- is C7H2ClF5.
What is the molecular weight of Benzene, 1-chloro-2,3-difluoro-5-(trifluoromethyl)-?
The molecular weight of Benzene, 1-chloro-2,3-difluoro-5-(trifluoromethyl)- is 215.98 g/mol.
Where can I buy Benzene, 1-chloro-2,3-difluoro-5-(trifluoromethyl)-?
You can request a quote for Benzene, 1-chloro-2,3-difluoro-5-(trifluoromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1-chloro-2,3-difluoro-5-(trifluoromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1-chloro-2,3-difluoro-5-(trifluoromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.