![1-[Chloro(chlorosulfanyl)(phenylsulfanyl)methanesulfonyl]-4-methylbenzene structure](/static/products/5953/59534-02-0.webp)
1-[Chloro(chlorosulfanyl)(phenylsulfanyl)methanesulfonyl]-4-methylbenzene
TL;DR: 1-[Chloro(chlorosulfanyl)(phenylsulfanyl)methanesulfonyl]-4-methylbenzene (CAS 59534-02-0) is a chemical compound with molecular formula C14H12Cl2O2S3 and molecular weight 377.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[chloro-(4-methylphenyl)sulfonyl-phenylsulfanylmethyl] thiohypochlorite
Also Known As: 1,6-dibromo-hex-3t-ene, [chloro-(4-methylphenyl)sulfonyl-phenylsulfanylmethyl] thioh, [chloro-(4-methylphenyl)sulfonyl-phenylsulfanylmethyl] thiohypochlorite, 1-[Chloro(chlorosulfanyl)(phenylsulfanyl)methanesulfonyl]-4-methylbenzene, Methanesulfenylchloride, chloro[(4-methylphenyl)sulfonyl](phenylthio)-
| Molecular Formula | C14H12Cl2O2S3 |
|---|---|
| Molecular Weight | 377.94 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 93.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 377.93765 |
| Heavy Atoms | 21 |
| Complexity | 424.0 |
Chemical Identifiers
| CAS Number | 59534-02-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C(SC2=CC=CC=C2)(SCl)Cl |
| InChIKey | YGXIWLWSNVHZAK-UHFFFAOYSA-N |
Product Overview
1-[Chloro(chlorosulfanyl)(phenylsulfanyl)methanesulfonyl]-4-methylbenzene (CAS 59534-02-0), with molecular formula C14H12Cl2O2S3 and molecular weight 377.94 g/mol. IUPAC: [chloro-(4-methylphenyl)sulfonyl-phenylsulfanylmethyl] thiohypochlorite.
Chemical Property Profile of 1-[Chloro(chlorosulfanyl)(phenylsulfanyl)methanesulfonyl]-4-methylbenzene
Property Insights of 1-[Chloro(chlorosulfanyl)(phenylsulfanyl)methanesulfonyl]-4-methylbenzene
The XLogP value of 5.5 indicates that 1-[Chloro(chlorosulfanyl)(phenylsulfanyl)methanesulfonyl]-4-methylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[Chloro(chlorosulfanyl)(phenylsulfanyl)methanesulfonyl]-4-methylbenzene. Following Lipinski's Rule of Five, 1-[Chloro(chlorosulfanyl)(phenylsulfanyl)methanesulfonyl]-4-methylbenzene has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-[Chloro(chlorosulfanyl)(phenylsulfanyl)methanesulfonyl]-4-methylbenzene?
The CAS number of 1-[Chloro(chlorosulfanyl)(phenylsulfanyl)methanesulfonyl]-4-methylbenzene is 59534-02-0.
What is the molecular formula of 1-[Chloro(chlorosulfanyl)(phenylsulfanyl)methanesulfonyl]-4-methylbenzene?
The molecular formula of 1-[Chloro(chlorosulfanyl)(phenylsulfanyl)methanesulfonyl]-4-methylbenzene is C14H12Cl2O2S3.
What is the molecular weight of 1-[Chloro(chlorosulfanyl)(phenylsulfanyl)methanesulfonyl]-4-methylbenzene?
The molecular weight of 1-[Chloro(chlorosulfanyl)(phenylsulfanyl)methanesulfonyl]-4-methylbenzene is 377.94 g/mol.
Where can I buy 1-[Chloro(chlorosulfanyl)(phenylsulfanyl)methanesulfonyl]-4-methylbenzene?
You can request a quote for 1-[Chloro(chlorosulfanyl)(phenylsulfanyl)methanesulfonyl]-4-methylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[Chloro(chlorosulfanyl)(phenylsulfanyl)methanesulfonyl]-4-methylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-[Chloro(chlorosulfanyl)(phenylsulfanyl)methanesulfonyl]-4-methylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.