3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-, oxime
TL;DR: 3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-, oxime (CAS 101833-14-1) is a chemical compound with molecular formula C6H5F6NO2 and molecular weight 237.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5,5-bis(trifluoromethyl)oxolan-3-ylidene]hydroxylamine
Also Known As: NCI60_022371, 2,2-Bis(trifluoromethyl)-4-tetrahydrofuranone oxime, 3(2H)-Furanone,dihydro-5,5-bis(trifluoromethyl)-, oxime, 3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-, oxime, N-[5,5-bis(trifluoromethyl)oxolan-3-ylidene]hydroxylamine
| Molecular Formula | C6H5F6NO2 |
|---|---|
| Molecular Weight | 237.02 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 41.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 0 |
| Exact Mass | 237.02245 |
| Heavy Atoms | 15 |
| Complexity | 266.0 |
Chemical Identifiers
| CAS Number | 101833-14-1 |
|---|---|
| SMILES | C1C(=NO)COC1(C(F)(F)F)C(F)(F)F |
| InChIKey | HTRRXCXXRORWGE-UHFFFAOYSA-N |
Product Overview
3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-, oxime (CAS 101833-14-1), with molecular formula C6H5F6NO2 and molecular weight 237.02 g/mol. IUPAC: N-[5,5-bis(trifluoromethyl)oxolan-3-ylidene]hydroxylamine.
Chemical Property Profile of 3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-, oxime
Property Insights of 3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-, oxime
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-, oxime. With a topological polar surface area (TPSA) of 41.8 Ų, 3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-, oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-, oxime has 1 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 3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-, oxime?
The CAS number of 3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-, oxime is 101833-14-1.
What is the molecular formula of 3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-, oxime?
The molecular formula of 3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-, oxime is C6H5F6NO2.
What is the molecular weight of 3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-, oxime?
The molecular weight of 3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-, oxime is 237.02 g/mol.
Where can I buy 3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-, oxime?
You can request a quote for 3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-, oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-, oxime?
Yes, KEHONG BIO provides custom synthesis services for 3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-, oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.