2-Propanone, 1,1,1,3,3-pentafluoro-3-nitro-
TL;DR: 2-Propanone, 1,1,1,3,3-pentafluoro-3-nitro- (CAS 3888-00-4) is a chemical compound with molecular formula C3F5NO3 and molecular weight 192.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,1,3,3-pentafluoro-3-nitropropan-2-one
Also Known As: Perfluornitroaceton, pentafluoronitroacetone, 1,1,1,3,3-pentafluoro-3-nitropropan-2-one, 2-Propanone, 1,1,1,3,3-pentafluoro-3-nitro-, 1,1,1,3,3-Pentafluoro-3-nitro2-propanone
| Molecular Formula | C3F5NO3 |
|---|---|
| Molecular Weight | 192.98 g/mol |
| LogP | 0.9873 |
| Topological Polar Surface Area | 60.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 192.97983 |
| Heavy Atoms | 12 |
| Complexity | 220.46857 |
Chemical Identifiers
| CAS Number | 3888-00-4 |
|---|---|
| SMILES | C(=O)(C([N+](=O)[O-])(F)F)C(F)(F)F |
Product Overview
2-Propanone, 1,1,1,3,3-pentafluoro-3-nitro- (CAS 3888-00-4), with molecular formula C3F5NO3 and molecular weight 192.98 g/mol. IUPAC: 1,1,1,3,3-pentafluoro-3-nitropropan-2-one.
Chemical Property Profile of 2-Propanone, 1,1,1,3,3-pentafluoro-3-nitro-
Property Insights of 2-Propanone, 1,1,1,3,3-pentafluoro-3-nitro-
The XLogP value of 0.9873 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propanone, 1,1,1,3,3-pentafluoro-3-nitro-. The TPSA of 60.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propanone, 1,1,1,3,3-pentafluoro-3-nitro-. Following Lipinski's Rule of Five, 2-Propanone, 1,1,1,3,3-pentafluoro-3-nitro- has 0 hydrogen bond donor(s) and 3 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-Propanone, 1,1,1,3,3-pentafluoro-3-nitro-?
The CAS number of 2-Propanone, 1,1,1,3,3-pentafluoro-3-nitro- is 3888-00-4.
What is the molecular formula of 2-Propanone, 1,1,1,3,3-pentafluoro-3-nitro-?
The molecular formula of 2-Propanone, 1,1,1,3,3-pentafluoro-3-nitro- is C3F5NO3.
What is the molecular weight of 2-Propanone, 1,1,1,3,3-pentafluoro-3-nitro-?
The molecular weight of 2-Propanone, 1,1,1,3,3-pentafluoro-3-nitro- is 192.98 g/mol.
Where can I buy 2-Propanone, 1,1,1,3,3-pentafluoro-3-nitro-?
You can request a quote for 2-Propanone, 1,1,1,3,3-pentafluoro-3-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propanone, 1,1,1,3,3-pentafluoro-3-nitro-?
Yes, KEHONG BIO provides custom synthesis services for 2-Propanone, 1,1,1,3,3-pentafluoro-3-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.