1-己烷磺酰氟
TL;DR: 1-己烷磺酰氟 (CAS 65269-96-7) is a chemical compound with molecular formula C6H13FO2S and molecular weight 168.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-己烷磺酰氟
hexane-1-sulfonyl fluoride
Also Known As: 1-Hexanesulfonyl fluoride, hexane-1-sulfonyl fluoride, Hexanesulfonyl fluoride, Hexane-1-sulphonyl fluoride, 1-Hexanesulfonylfluoride
| Molecular Formula | C6H13FO2S |
|---|---|
| Molecular Weight | 168.06 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 168.06203 |
| Heavy Atoms | 10 |
| Complexity | 157.0 |
Chemical Identifiers
| CAS Number | 65269-96-7 |
|---|---|
| SMILES | CCCCCCS(=O)(=O)F |
| InChIKey | DNCIDNCRBAKPTP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-己烷磺酰氟 (CAS 65269-96-7), with molecular formula C6H13FO2S and molecular weight 168.06 g/mol. IUPAC: hexane-1-sulfonyl fluoride.
Chemical Property Profile of 1-己烷磺酰氟
Property Insights of 1-己烷磺酰氟
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-己烷磺酰氟. With a topological polar surface area (TPSA) of 42.5 Ų, 1-己烷磺酰氟 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-己烷磺酰氟 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 1-己烷磺酰氟?
The CAS number of 1-己烷磺酰氟 is 65269-96-7.
What is the molecular formula of 1-己烷磺酰氟?
The molecular formula of 1-己烷磺酰氟 is C6H13FO2S.
What is the molecular weight of 1-己烷磺酰氟?
The molecular weight of 1-己烷磺酰氟 is 168.06 g/mol.
Where can I buy 1-己烷磺酰氟?
You can request a quote for 1-己烷磺酰氟 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-己烷磺酰氟?
Yes, KEHONG BIO provides custom synthesis services for 1-己烷磺酰氟 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.