Home Bromides 16582-78-8
16582-78-8,MFCD11855822
Catalog No.:AA003IZM

16582-78-8 | 3-Bromo-4-thiocyanatoaniline

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$62.00   $44.00
- +
5g
97%
in stock  
$162.00   $113.00
- +
25g
97%
in stock  
$477.00   $334.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003IZM
Chemical Name:
3-Bromo-4-thiocyanatoaniline
CAS Number:
16582-78-8
Molecular Formula:
C7H5BrN2S
Molecular Weight:
229.0970
MDL Number:
MFCD11855822
SMILES:
N#CSc1ccc(cc1Br)N
Properties
Properties
 
Storage:
Room Temperature;  

Computed Properties
 
Complexity:
177  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
2.5  

Downstream Synthesis Route
ammoniumthiocyanate 
  591-19-5    16582-78-8 

[1]Locationinpatent:experimentalpartPan,Xiang-Qiang;Lei,Mao-Yi;Zou,Jian-Ping;Zhang,Wei[TetrahedronLetters,2009,vol.50,#3,p.347-349]

[1]Locationinpatent:experimentalpartKhazaei,Ardeshir;Zolfigol,MohammadAli;Mokhlesi,Mohmmad;Panah,FatemeDerakhshan;Sajjadifar,Sami[HelveticaChimicaActa,2012,vol.95,#1,p.106-114]

[2]Locationinpatent:experimentalpartZolfigol,MohammadAli;Khazaei,Ardeshir;Mokhlesi,Mohammad;Vahedi,Hoshang;Sajadifar,Sami;Pirveysian,Mahtab[Phosphorus,SulfurandSiliconandtheRelatedElements,2012,vol.187,#3,p.295-304]

[3]Jiang,Huanfeng;Yu,Wentao;Tang,Xiaodong;Li,Jianxiao;Wu,Wanqing[JournalofOrganicChemistry,2017,vol.82,#18,p.9312-9320]

[4]Locationinpatent:experimentalpartKhazaei,Ardeshir;Zolfigol,MohammadAli;Safaiee,Maliheh;Mokhlesi,Mohammad;Donyadari,Elmira;Shiri,Morteza;Kruger,HendrikGerhardus[CatalysisCommunications,2012,vol.26,p.34-38]

[5]Locationinpatent:experimentalpartKhazaei,Ardeshir;Zolfigol,MohammadAli;Mokhlesi,Mohmmad;Pirveysian,Mahtab[CanadianJournalofChemistry,2012,vol.90,#5,p.427-432]

[1]Dass,Reuben;Singleton,JustinD.;Peterson,MattA.[TetrahedronLetters,2022,vol.98]

[2]CurrentPatentAssignee:UNIVHAINANTROPICALOCEAN;SOOCHOWUNIVERSITY(SUZHOU)-CN111454185,2020,ALocationinpatent:Paragraph0050-0053

[3]Chauhan,Parul;Ritu;Preeti;Kumar,Sharvan;Jain,Nidhi[EuropeanJournalofOrganicChemistry,2019,vol.2019,#27,p.4334-4340]

Literature
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SDS
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Tags:16582-78-8 Molecular Formula|16582-78-8 MDL|16582-78-8 SMILES|16582-78-8 3-Bromo-4-thiocyanatoaniline