N-butyl-N-tert-butylsulfanylbutan-1-amine
TL;DR: N-butyl-N-tert-butylsulfanylbutan-1-amine (CAS 108751-71-9) is a chemical compound with molecular formula C12H27NS and molecular weight 217.18642 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-butyl-N-tert-butylsulfanylbutan-1-amine
Also Known As: NIOSH/KI7065000, t-Butylsulfenamide, N,N-dibutyl, N-butyl-N-tert-butylsulfanylbutan-1-amine, 1-[butyl(tert-butylsulfanyl)amino]butane, N,N-Di-n-butyltrimethylmethanesulfenamide
Technical Specifications
| Molecular Formula | C12H27NS |
| Molecular Weight | 217.18642 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 28.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 217.18642 Da |
| Heavy Atoms | 14 |
| Complexity | 121.0 |
| SMILES | CCCCN(CCCC)SC(C)(C)C |
| InChIKey | ODNHKHGYKKAJQN-UHFFFAOYSA-N |
Chemical Property Profile of N-butyl-N-tert-butylsulfanylbutan-1-amine
Property Insights of N-butyl-N-tert-butylsulfanylbutan-1-amine
The XLogP value of 4.2 indicates that N-butyl-N-tert-butylsulfanylbutan-1-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.5 Ų, N-butyl-N-tert-butylsulfanylbutan-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-butyl-N-tert-butylsulfanylbutan-1-amine 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
What is the CAS number of N-butyl-N-tert-butylsulfanylbutan-1-amine?
The CAS number of N-butyl-N-tert-butylsulfanylbutan-1-amine is 108751-71-9.
What is the molecular formula of N-butyl-N-tert-butylsulfanylbutan-1-amine?
The molecular formula of N-butyl-N-tert-butylsulfanylbutan-1-amine is C12H27NS.
What is the molecular weight of N-butyl-N-tert-butylsulfanylbutan-1-amine?
The molecular weight of N-butyl-N-tert-butylsulfanylbutan-1-amine is 217.18642 g/mol.
Where can I buy N-butyl-N-tert-butylsulfanylbutan-1-amine?
You can request a quote for N-butyl-N-tert-butylsulfanylbutan-1-amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-butyl-N-tert-butylsulfanylbutan-1-amine?
Yes, CoreyChem provides custom synthesis services for N-butyl-N-tert-butylsulfanylbutan-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.