o-((o-Chlorophenyl)thio)aniline
TL;DR: o-((o-Chlorophenyl)thio)aniline (CAS 4726-30-1) is a chemical compound with molecular formula C12H10ClNS and molecular weight 235.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-chlorophenyl)sulfanylaniline
Also Known As: NIOSH/BX0877000, o-((o-Chlorophenyl)thio)aniline, 2-Amino-2'-chlorodiphenyl sulphide, Aniline, o-((o-chlorophenyl)thio)-, 2-(2-chlorophenyl)sulfanylaniline
| Molecular Formula | C12H10ClNS |
|---|---|
| Molecular Weight | 235.02 g/mol |
| LogP | 4.0734 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.02225 |
| Heavy Atoms | 15 |
| Complexity | 427.18423 |
Chemical Identifiers
| CAS Number | 4726-30-1 |
|---|---|
| SMILES | C1=CC=C(C(=C1)N)SC2=CC=CC=C2Cl |
Product Overview
o-((o-Chlorophenyl)thio)aniline (CAS 4726-30-1), with molecular formula C12H10ClNS and molecular weight 235.02 g/mol. IUPAC: 2-(2-chlorophenyl)sulfanylaniline.
Chemical Property Profile of o-((o-Chlorophenyl)thio)aniline
Property Insights of o-((o-Chlorophenyl)thio)aniline
The XLogP value of 4.0734 indicates that o-((o-Chlorophenyl)thio)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.02 Ų, o-((o-Chlorophenyl)thio)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, o-((o-Chlorophenyl)thio)aniline has 1 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 o-((o-Chlorophenyl)thio)aniline?
The CAS number of o-((o-Chlorophenyl)thio)aniline is 4726-30-1.
What is the molecular formula of o-((o-Chlorophenyl)thio)aniline?
The molecular formula of o-((o-Chlorophenyl)thio)aniline is C12H10ClNS.
What is the molecular weight of o-((o-Chlorophenyl)thio)aniline?
The molecular weight of o-((o-Chlorophenyl)thio)aniline is 235.02 g/mol.
Where can I buy o-((o-Chlorophenyl)thio)aniline?
You can request a quote for o-((o-Chlorophenyl)thio)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for o-((o-Chlorophenyl)thio)aniline?
Yes, KEHONG BIO provides custom synthesis services for o-((o-Chlorophenyl)thio)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.