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2-[(2-Bromo-4-nitrophenyl)sulfanyl]-1,3-dichlorobenzene
TL;DR: 2-[(2-Bromo-4-nitrophenyl)sulfanyl]-1,3-dichlorobenzene (CAS 477888-99-6) is a chemical compound with molecular formula C12H6BrCl2NO2S and molecular weight 376.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-bromo-4-nitrophenyl)sulfanyl-1,3-dichlorobenzene
Also Known As: Bionet1_004197, DivK1c_002693, 2-[(2-bromo-4-nitrophenyl)sulfanyl]-1,3-dichlorobenzene, CDS1_001653, 2-(2-bromo-4-nitrophenyl)sulfanyl-1,3-dichlorobenzene
| Molecular Formula | C12H6BrCl2NO2S |
|---|---|
| Molecular Weight | 376.87 g/mol |
| LogP | 5.8153 |
| Topological Polar Surface Area | 43.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 376.86798 |
| Heavy Atoms | 19 |
| Complexity | 631.37164 |
Chemical Identifiers
| CAS Number | 477888-99-6 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)SC2=C(C=C(C=C2)[N+](=O)[O-])Br)Cl |
Product Overview
2-[(2-Bromo-4-nitrophenyl)sulfanyl]-1,3-dichlorobenzene (CAS 477888-99-6), with molecular formula C12H6BrCl2NO2S and molecular weight 376.87 g/mol. IUPAC: 2-(2-bromo-4-nitrophenyl)sulfanyl-1,3-dichlorobenzene.
Chemical Property Profile of 2-[(2-Bromo-4-nitrophenyl)sulfanyl]-1,3-dichlorobenzene
Property Insights of 2-[(2-Bromo-4-nitrophenyl)sulfanyl]-1,3-dichlorobenzene
The XLogP value of 5.8153 indicates that 2-[(2-Bromo-4-nitrophenyl)sulfanyl]-1,3-dichlorobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.14 Ų, 2-[(2-Bromo-4-nitrophenyl)sulfanyl]-1,3-dichlorobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(2-Bromo-4-nitrophenyl)sulfanyl]-1,3-dichlorobenzene has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[(2-Bromo-4-nitrophenyl)sulfanyl]-1,3-dichlorobenzene?
The CAS number of 2-[(2-Bromo-4-nitrophenyl)sulfanyl]-1,3-dichlorobenzene is 477888-99-6.
What is the molecular formula of 2-[(2-Bromo-4-nitrophenyl)sulfanyl]-1,3-dichlorobenzene?
The molecular formula of 2-[(2-Bromo-4-nitrophenyl)sulfanyl]-1,3-dichlorobenzene is C12H6BrCl2NO2S.
What is the molecular weight of 2-[(2-Bromo-4-nitrophenyl)sulfanyl]-1,3-dichlorobenzene?
The molecular weight of 2-[(2-Bromo-4-nitrophenyl)sulfanyl]-1,3-dichlorobenzene is 376.87 g/mol.
Where can I buy 2-[(2-Bromo-4-nitrophenyl)sulfanyl]-1,3-dichlorobenzene?
You can request a quote for 2-[(2-Bromo-4-nitrophenyl)sulfanyl]-1,3-dichlorobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2-Bromo-4-nitrophenyl)sulfanyl]-1,3-dichlorobenzene?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2-Bromo-4-nitrophenyl)sulfanyl]-1,3-dichlorobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.