1,3,5-Tritert-butyl-2-(sulfinylamino)benzene
TL;DR: 1,3,5-Tritert-butyl-2-(sulfinylamino)benzene (CAS 68761-21-7) is a chemical compound with molecular formula C18H29NOS and molecular weight 307.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,5-tritert-butyl-2-(sulfinylamino)benzene
Also Known As: 2,4,6-tritert-butyl-N-sulfinylaniline, 1,3,5-tritert-butyl-2-(sulfinylamino)benzene, 2,4,6-tri-tert-butyl-N-(oxo-, N-sulfinyl-2,4,6-tri-t-butyl-benzenamine, Benzenamine, 2,4,6-tris(1,1-dimethylethyl)-N-sulfinyl-
| Molecular Formula | C18H29NOS |
|---|---|
| Molecular Weight | 307.20 g/mol |
| LogP | 5.6072 |
| Topological Polar Surface Area | 29.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 307.197 |
| Heavy Atoms | 21 |
| Complexity | 541.7017 |
Chemical Identifiers
| CAS Number | 68761-21-7 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)N=S=O)C(C)(C)C |
Product Overview
1,3,5-Tritert-butyl-2-(sulfinylamino)benzene (CAS 68761-21-7), with molecular formula C18H29NOS and molecular weight 307.20 g/mol. IUPAC: 1,3,5-tritert-butyl-2-(sulfinylamino)benzene.
Chemical Property Profile of 1,3,5-Tritert-butyl-2-(sulfinylamino)benzene
Property Insights of 1,3,5-Tritert-butyl-2-(sulfinylamino)benzene
The XLogP value of 5.6072 indicates that 1,3,5-Tritert-butyl-2-(sulfinylamino)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.43 Ų, 1,3,5-Tritert-butyl-2-(sulfinylamino)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,5-Tritert-butyl-2-(sulfinylamino)benzene has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3,5-Tritert-butyl-2-(sulfinylamino)benzene?
The CAS number of 1,3,5-Tritert-butyl-2-(sulfinylamino)benzene is 68761-21-7.
What is the molecular formula of 1,3,5-Tritert-butyl-2-(sulfinylamino)benzene?
The molecular formula of 1,3,5-Tritert-butyl-2-(sulfinylamino)benzene is C18H29NOS.
What is the molecular weight of 1,3,5-Tritert-butyl-2-(sulfinylamino)benzene?
The molecular weight of 1,3,5-Tritert-butyl-2-(sulfinylamino)benzene is 307.20 g/mol.
Where can I buy 1,3,5-Tritert-butyl-2-(sulfinylamino)benzene?
You can request a quote for 1,3,5-Tritert-butyl-2-(sulfinylamino)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,5-Tritert-butyl-2-(sulfinylamino)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1,3,5-Tritert-butyl-2-(sulfinylamino)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.