五氟苯甲酰氯
TL;DR: 五氟苯甲酰氯 (CAS 2251-50-5) is a chemical compound with molecular formula C7ClF5O and molecular weight 229.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
五氟苯甲酰氯
2,3,4,5,6-pentafluorobenzoyl chloride
Also Known As: Pentafluorobenzoyl chloride, 2,3,4,5,6-Pentafluorobenzoyl chloride, pentafluorobenzoylchloride, Perfluorobenzoyl chloride, Benzoyl chloride, pentafluoro-
| Molecular Formula | C7ClF5O |
|---|---|
| Molecular Weight | 229.96 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 229.95578 |
| Heavy Atoms | 14 |
| Complexity | 222.0 |
Chemical Identifiers
| CAS Number | 2251-50-5 |
|---|---|
| SMILES | C1(=C(C(=C(C(=C1F)F)F)F)F)C(=O)Cl |
| InChIKey | MYHOHFDYWMPGJY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
五氟苯甲酰氯 (CAS 2251-50-5), with molecular formula C7ClF5O and molecular weight 229.96 g/mol. IUPAC: 2,3,4,5,6-pentafluorobenzoyl chloride.
Chemical Property Profile of 五氟苯甲酰氯
Property Insights of 五氟苯甲酰氯
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 五氟苯甲酰氯. With a topological polar surface area (TPSA) of 17.1 Ų, 五氟苯甲酰氯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 五氟苯甲酰氯 has 0 hydrogen bond donor(s) and 6 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 五氟苯甲酰氯?
The CAS number of 五氟苯甲酰氯 is 2251-50-5.
What is the molecular formula of 五氟苯甲酰氯?
The molecular formula of 五氟苯甲酰氯 is C7ClF5O.
What is the molecular weight of 五氟苯甲酰氯?
The molecular weight of 五氟苯甲酰氯 is 229.96 g/mol.
Where can I buy 五氟苯甲酰氯?
You can request a quote for 五氟苯甲酰氯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 五氟苯甲酰氯?
Yes, KEHONG BIO provides custom synthesis services for 五氟苯甲酰氯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.