3,3,4,4,5,5,5-Heptafluoro-1-nitropentan-2-ol
TL;DR: 3,3,4,4,5,5,5-Heptafluoro-1-nitropentan-2-ol (CAS 377-61-7) is a chemical compound with molecular formula C5H4F7NO3 and molecular weight 259.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3,4,4,5,5,5-heptafluoro-1-nitropentan-2-ol
Also Known As: 3,3,4,4,5,5,5-heptafluoro-1-nitropentan-2-ol, RefChem:270009
| Molecular Formula | C5H4F7NO3 |
|---|---|
| Molecular Weight | 259.01 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 66.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 259.00793 |
| Heavy Atoms | 16 |
| Complexity | 270.0 |
Chemical Identifiers
| CAS Number | 377-61-7 |
|---|---|
| SMILES | C(C(C(C(C(F)(F)F)(F)F)(F)F)O)[N+](=O)[O-] |
| InChIKey | ZXFRDGBMIGOQJL-UHFFFAOYSA-N |
Product Overview
3,3,4,4,5,5,5-Heptafluoro-1-nitropentan-2-ol (CAS 377-61-7), with molecular formula C5H4F7NO3 and molecular weight 259.01 g/mol. IUPAC: 3,3,4,4,5,5,5-heptafluoro-1-nitropentan-2-ol.
Chemical Property Profile of 3,3,4,4,5,5,5-Heptafluoro-1-nitropentan-2-ol
Property Insights of 3,3,4,4,5,5,5-Heptafluoro-1-nitropentan-2-ol
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3,4,4,5,5,5-Heptafluoro-1-nitropentan-2-ol. The TPSA of 66.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3,4,4,5,5,5-Heptafluoro-1-nitropentan-2-ol. Following Lipinski's Rule of Five, 3,3,4,4,5,5,5-Heptafluoro-1-nitropentan-2-ol has 1 hydrogen bond donor(s) and 10 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 3,3,4,4,5,5,5-Heptafluoro-1-nitropentan-2-ol?
The CAS number of 3,3,4,4,5,5,5-Heptafluoro-1-nitropentan-2-ol is 377-61-7.
What is the molecular formula of 3,3,4,4,5,5,5-Heptafluoro-1-nitropentan-2-ol?
The molecular formula of 3,3,4,4,5,5,5-Heptafluoro-1-nitropentan-2-ol is C5H4F7NO3.
What is the molecular weight of 3,3,4,4,5,5,5-Heptafluoro-1-nitropentan-2-ol?
The molecular weight of 3,3,4,4,5,5,5-Heptafluoro-1-nitropentan-2-ol is 259.01 g/mol.
Where can I buy 3,3,4,4,5,5,5-Heptafluoro-1-nitropentan-2-ol?
You can request a quote for 3,3,4,4,5,5,5-Heptafluoro-1-nitropentan-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3,4,4,5,5,5-Heptafluoro-1-nitropentan-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 3,3,4,4,5,5,5-Heptafluoro-1-nitropentan-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.