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6258-66-8,MFCD00004870
Catalog No.:AA0033X3

6258-66-8 | 4-Chlorobenzyl mercaptan

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
95%
in stock  
$18.00   $13.00
- +
25g
98%
in stock  
$26.00   $18.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0033X3
Chemical Name:
4-Chlorobenzyl mercaptan
CAS Number:
6258-66-8
Molecular Formula:
C7H7ClS
Molecular Weight:
158.6485
MDL Number:
MFCD00004870
SMILES:
SCc1ccc(cc1)Cl
NSC Number:
108735
Properties
Properties
 
BP:
125°C 35mm  
Form:
Liquid  
MP:
19-20 °C(lit.)  
Refractive Index:
n20/D 1.5893(lit.)  
Stability:
Stench  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
77  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
2.9  

Downstream Synthesis Route

[1]JournalofChemicalResearch-PartS,1998,p.212-213

[2]TetrahedronLetters,1985,vol.26,p.469-472

[3]CorrosionetAnticorrosion,1956,vol.4,p.4,14

[4]JustusLiebigsAnnalenderChemie,1860,vol.116,p.357

[5]JournalofMedicinalChemistry,1992,vol.35,p.3613-3624

[6]CanadianJournalofChemistry,1956,vol.34,p.1093,1099

[1]Soperetal.[JournaloftheAmericanChemicalSociety,1948,vol.70,p.2849,2851]Newman;Fones;Renoll[JournaloftheAmericanChemicalSociety,1947,vol.69,p.718,721]

[1]CanadianJournalofChemistry,1956,vol.34,p.1093,1099

[1]TetrahedronLetters,2007,vol.48,p.7668-7670

[2]OrganicandBiomolecularChemistry,2018,vol.16,p.4236-4242

[3]MonatsheftefurChemie,2006,vol.137,p.307-310

[4]Phosphorus,SulfurandSiliconandtheRelatedElements,2009,vol.184,p.2553-2559

[5]TetrahedronLetters,2011,vol.52,p.640-643

[6]TetrahedronLetters,2015,vol.56,p.5578-5582

[7]ChemicalCommunications,2016,vol.52,p.8448-8451

[8]Phosphorus,SulfurandSiliconandtheRelatedElements,2009,vol.184,p.2058-2065

[9]LettersinOrganicChemistry,2010,vol.7,p.415-419

[10]GreenChemistry,2017,vol.19,p.2286-2295

[11]JournaloftheChemicalSociety,1945,p.666,671

[12]Chemistry-AEuropeanJournal,2007,vol.13,p.7983-7995

[13]Synthesis,2016,vol.48,p.3087-3096

[1]JournalofMedicinalChemistry,1969,vol.12,p.550-551

[2]BioorganicandMedicinalChemistryLetters,2013,vol.23,p.2426-2431

Literature

Title: S-benzylisothiourea derivatives as small-molecule inhibitors of indoleamine-2,3-dioxygenase.

Journal: Bioorganic & medicinal chemistry letters 20100901

Title: Chemical genomics in Escherichia coli identifies an inhibitor of bacterial lipoprotein targeting.

Journal: Nature chemical biology 20091101

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