Propane, 1-nitro-2-(2-propenylthio)-
TL;DR: Propane, 1-nitro-2-(2-propenylthio)- (CAS 127865-37-6) is a chemical compound with molecular formula C6H11NO2S and molecular weight 161.05106 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-nitro-2-prop-2-enylsulfanylpropane
Also Known As: 2-(allylthio)-1-nitro-propane, Propane, 1-nitro-2-(2-propenylthio)-, 1-nitro-2-prop-2-enylsulfanylpropane, [1-Methyl-2-nitroethyl]2-propenyl sulfide, 3-[(1-nitropropan-2-yl)sulfanyl]prop-1-ene
Technical Specifications
| Molecular Formula | C6H11NO2S |
| Molecular Weight | 161.05106 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 71.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 161.05106 Da |
| Heavy Atoms | 10 |
| Complexity | 121.0 |
| SMILES | CC(C[N+](=O)[O-])SCC=C |
| InChIKey | DNSZJHNUSMQUBR-UHFFFAOYSA-N |
Chemical Property Profile of Propane, 1-nitro-2-(2-propenylthio)-
Property Insights of Propane, 1-nitro-2-(2-propenylthio)-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propane, 1-nitro-2-(2-propenylthio)-. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Propane, 1-nitro-2-(2-propenylthio)-. Following Lipinski's Rule of Five, Propane, 1-nitro-2-(2-propenylthio)- 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
What is the CAS number of Propane, 1-nitro-2-(2-propenylthio)-?
The CAS number of Propane, 1-nitro-2-(2-propenylthio)- is 127865-37-6.
What is the molecular formula of Propane, 1-nitro-2-(2-propenylthio)-?
The molecular formula of Propane, 1-nitro-2-(2-propenylthio)- is C6H11NO2S.
What is the molecular weight of Propane, 1-nitro-2-(2-propenylthio)-?
The molecular weight of Propane, 1-nitro-2-(2-propenylthio)- is 161.05106 g/mol.
Where can I buy Propane, 1-nitro-2-(2-propenylthio)-?
You can request a quote for Propane, 1-nitro-2-(2-propenylthio)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Propane, 1-nitro-2-(2-propenylthio)-?
Yes, CoreyChem provides custom synthesis services for Propane, 1-nitro-2-(2-propenylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.