Valeronitrile, 5-fluoro-
TL;DR: Valeronitrile, 5-fluoro- (CAS 353-13-9) is a chemical compound with molecular formula C5H8FN and molecular weight 101.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-fluoropentanenitrile
Also Known As: 5-fluoropentanenitrile, 5-Fluorovaleronitrile, Valeronitrile, 5-fluoro-, 5-Fluorpentannitril, Pentanenitrile, 5-fluoro-
| Molecular Formula | C5H8FN |
|---|---|
| Molecular Weight | 101.06 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 101.06408 |
| Heavy Atoms | 7 |
| Complexity | 71.0 |
Chemical Identifiers
| CAS Number | 353-13-9 |
|---|---|
| SMILES | C(CCF)CC#N |
| InChIKey | TZKGRFZSJHYEOY-UHFFFAOYSA-N |
Product Overview
Valeronitrile, 5-fluoro- (CAS 353-13-9), with molecular formula C5H8FN and molecular weight 101.06 g/mol. IUPAC: 5-fluoropentanenitrile.
Chemical Property Profile of Valeronitrile, 5-fluoro-
Property Insights of Valeronitrile, 5-fluoro-
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Valeronitrile, 5-fluoro-. With a topological polar surface area (TPSA) of 23.8 Ų, Valeronitrile, 5-fluoro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Valeronitrile, 5-fluoro- has 0 hydrogen bond donor(s) and 2 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 Valeronitrile, 5-fluoro-?
The CAS number of Valeronitrile, 5-fluoro- is 353-13-9.
What is the molecular formula of Valeronitrile, 5-fluoro-?
The molecular formula of Valeronitrile, 5-fluoro- is C5H8FN.
What is the molecular weight of Valeronitrile, 5-fluoro-?
The molecular weight of Valeronitrile, 5-fluoro- is 101.06 g/mol.
Where can I buy Valeronitrile, 5-fluoro-?
You can request a quote for Valeronitrile, 5-fluoro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Valeronitrile, 5-fluoro-?
Yes, KEHONG BIO provides custom synthesis services for Valeronitrile, 5-fluoro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.