2-Hepten-4-one, 6-(chlorodifluoromethyl)-6-hydroxy-2-methyl-7,7,7-trifluoro-
TL;DR: 2-Hepten-4-one, 6-(chlorodifluoromethyl)-6-hydroxy-2-methyl-7,7,7-trifluoro- (CAS 34844-12-7) is a chemical compound with molecular formula C9H10ClF5O2 and molecular weight 280.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[chloro(difluoro)methyl]-7,7,7-trifluoro-6-hydroxy-2-methylhept-2-en-4-one
Also Known As: 7-Chloro-7,7-difluoro-6-hydroxy-2-methyl-6-trifluoromethyl-2-hepten-4-one, 2-HEPTEN-4-ONE, 6-(CHLORODIFLUOROMETHYL)-6-HYDROXY-2-METHYL-7,7,7-TRIFLUORO-, 7-Chloro-7,7-difluoro-6-hydroxy-6-trifluoromethyl-2-methyl-2-hepten-4-one, 6-[chloro(difluoro)methyl]-7,7,7-trifluoro-6-hydroxy-2-methy, 6-(Chlorodifluoromethyl)-6-hydroxy-2-methyl-7,7,7-trifluoro-2-hepten-4-one
| Molecular Formula | C9H10ClF5O2 |
|---|---|
| Molecular Weight | 280.03 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 280.02896 |
| Heavy Atoms | 17 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 34844-12-7 |
|---|---|
| SMILES | CC(=CC(=O)CC(C(F)(F)F)(C(F)(F)Cl)O)C |
| InChIKey | FHDHACRWSOLHLB-UHFFFAOYSA-N |
Product Overview
2-Hepten-4-one, 6-(chlorodifluoromethyl)-6-hydroxy-2-methyl-7,7,7-trifluoro- (CAS 34844-12-7), with molecular formula C9H10ClF5O2 and molecular weight 280.03 g/mol. IUPAC: 6-[chloro(difluoro)methyl]-7,7,7-trifluoro-6-hydroxy-2-methylhept-2-en-4-one.
Chemical Property Profile of 2-Hepten-4-one, 6-(chlorodifluoromethyl)-6-hydroxy-2-methyl-7,7,7-trifluoro-
Property Insights of 2-Hepten-4-one, 6-(chlorodifluoromethyl)-6-hydroxy-2-methyl-7,7,7-trifluoro-
The XLogP value of 3.0 indicates that 2-Hepten-4-one, 6-(chlorodifluoromethyl)-6-hydroxy-2-methyl-7,7,7-trifluoro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 2-Hepten-4-one, 6-(chlorodifluoromethyl)-6-hydroxy-2-methyl-7,7,7-trifluoro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Hepten-4-one, 6-(chlorodifluoromethyl)-6-hydroxy-2-methyl-7,7,7-trifluoro- has 1 hydrogen bond donor(s) and 7 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 2-Hepten-4-one, 6-(chlorodifluoromethyl)-6-hydroxy-2-methyl-7,7,7-trifluoro-?
The CAS number of 2-Hepten-4-one, 6-(chlorodifluoromethyl)-6-hydroxy-2-methyl-7,7,7-trifluoro- is 34844-12-7.
What is the molecular formula of 2-Hepten-4-one, 6-(chlorodifluoromethyl)-6-hydroxy-2-methyl-7,7,7-trifluoro-?
The molecular formula of 2-Hepten-4-one, 6-(chlorodifluoromethyl)-6-hydroxy-2-methyl-7,7,7-trifluoro- is C9H10ClF5O2.
What is the molecular weight of 2-Hepten-4-one, 6-(chlorodifluoromethyl)-6-hydroxy-2-methyl-7,7,7-trifluoro-?
The molecular weight of 2-Hepten-4-one, 6-(chlorodifluoromethyl)-6-hydroxy-2-methyl-7,7,7-trifluoro- is 280.03 g/mol.
Where can I buy 2-Hepten-4-one, 6-(chlorodifluoromethyl)-6-hydroxy-2-methyl-7,7,7-trifluoro-?
You can request a quote for 2-Hepten-4-one, 6-(chlorodifluoromethyl)-6-hydroxy-2-methyl-7,7,7-trifluoro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hepten-4-one, 6-(chlorodifluoromethyl)-6-hydroxy-2-methyl-7,7,7-trifluoro-?
Yes, KEHONG BIO provides custom synthesis services for 2-Hepten-4-one, 6-(chlorodifluoromethyl)-6-hydroxy-2-methyl-7,7,7-trifluoro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.