Hexane, 6-fluoro-1-nitro-
TL;DR: Hexane, 6-fluoro-1-nitro- (CAS 408-08-2) is a chemical compound with molecular formula C6H12FNO2 and molecular weight 149.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-fluoro-6-nitrohexane
Also Known As: 1-fluoro-6-nitrohexane, 6-Fluoro-1-nitrohexane, 1-Fluor-6-nitro-hexan, HEXANE, 6-FLUORO-1-NITRO-, 4-01-00-00356 (Beilstein Handbook Reference)
| Molecular Formula | C6H12FNO2 |
|---|---|
| Molecular Weight | 149.09 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 149.0852 |
| Heavy Atoms | 10 |
| Complexity | 92.0 |
Chemical Identifiers
| CAS Number | 408-08-2 |
|---|---|
| SMILES | C(CCCF)CC[N+](=O)[O-] |
| InChIKey | OQVYNPDNUMJKRL-UHFFFAOYSA-N |
Product Overview
Hexane, 6-fluoro-1-nitro- (CAS 408-08-2), with molecular formula C6H12FNO2 and molecular weight 149.09 g/mol. IUPAC: 1-fluoro-6-nitrohexane.
Chemical Property Profile of Hexane, 6-fluoro-1-nitro-
Property Insights of Hexane, 6-fluoro-1-nitro-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexane, 6-fluoro-1-nitro-. With a topological polar surface area (TPSA) of 45.8 Ų, Hexane, 6-fluoro-1-nitro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexane, 6-fluoro-1-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 Hexane, 6-fluoro-1-nitro-?
The CAS number of Hexane, 6-fluoro-1-nitro- is 408-08-2.
What is the molecular formula of Hexane, 6-fluoro-1-nitro-?
The molecular formula of Hexane, 6-fluoro-1-nitro- is C6H12FNO2.
What is the molecular weight of Hexane, 6-fluoro-1-nitro-?
The molecular weight of Hexane, 6-fluoro-1-nitro- is 149.09 g/mol.
Where can I buy Hexane, 6-fluoro-1-nitro-?
You can request a quote for Hexane, 6-fluoro-1-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexane, 6-fluoro-1-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Hexane, 6-fluoro-1-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.