2,4-Dichloro-1-(isocyano(tosyl)methyl)benzene
TL;DR: 2,4-Dichloro-1-(isocyano(tosyl)methyl)benzene (CAS 952727-77-4) is a chemical compound with molecular formula C15H11Cl2NO2S and molecular weight 338.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dichloro-1-[isocyano-(4-methylphenyl)sulfonylmethyl]benzene
Also Known As: a-Tosyl-(2,4-dichlorobenzyl) isocyanide, 2,4-DICHLORO-1-(ISOCYANO(TOSYL)METHYL)BENZENE, 2,4-DICHLORO-1-[ISOCYANO-(TOLUENE-4-SULFONYL)-METHYL]-BENZENE, a-Tosyl-(2,4-dichlorobenzyl)isocyanide, A-Tosyl-(24-dichlorobenzyl) isocyanide
| Molecular Formula | C15H11Cl2NO2S |
|---|---|
| Molecular Weight | 338.99 g/mol |
| LogP | 4.69361 |
| Topological Polar Surface Area | 38.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 338.98877 |
| Heavy Atoms | 21 |
| Complexity | 808.55756 |
Chemical Identifiers
| CAS Number | 952727-77-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C(C2=C(C=C(C=C2)Cl)Cl)[N+]#[C-] |
Product Overview
2,4-Dichloro-1-(isocyano(tosyl)methyl)benzene (CAS 952727-77-4), with molecular formula C15H11Cl2NO2S and molecular weight 338.99 g/mol. IUPAC: 2,4-dichloro-1-[isocyano-(4-methylphenyl)sulfonylmethyl]benzene.
Chemical Property Profile of 2,4-Dichloro-1-(isocyano(tosyl)methyl)benzene
Property Insights of 2,4-Dichloro-1-(isocyano(tosyl)methyl)benzene
The XLogP value of 4.69361 indicates that 2,4-Dichloro-1-(isocyano(tosyl)methyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.5 Ų, 2,4-Dichloro-1-(isocyano(tosyl)methyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Dichloro-1-(isocyano(tosyl)methyl)benzene 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 2,4-Dichloro-1-(isocyano(tosyl)methyl)benzene?
The CAS number of 2,4-Dichloro-1-(isocyano(tosyl)methyl)benzene is 952727-77-4.
What is the molecular formula of 2,4-Dichloro-1-(isocyano(tosyl)methyl)benzene?
The molecular formula of 2,4-Dichloro-1-(isocyano(tosyl)methyl)benzene is C15H11Cl2NO2S.
What is the molecular weight of 2,4-Dichloro-1-(isocyano(tosyl)methyl)benzene?
The molecular weight of 2,4-Dichloro-1-(isocyano(tosyl)methyl)benzene is 338.99 g/mol.
Where can I buy 2,4-Dichloro-1-(isocyano(tosyl)methyl)benzene?
You can request a quote for 2,4-Dichloro-1-(isocyano(tosyl)methyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dichloro-1-(isocyano(tosyl)methyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dichloro-1-(isocyano(tosyl)methyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.