Home Bromides 330792-93-3
330792-93-3,MFCD08446949
Catalog No.:AA00CHUU

330792-93-3 | 4-(4-Bromophenoxy)benzonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$112.00   $78.00
- +
1g
98%
in stock  
$261.00   $183.00
- +
5g
98%
in stock  
$760.00   $532.00
- +
10g
98%
in stock  
$1,258.00   $881.00
- +
25g
98%
in stock  
$2,140.00   $1,498.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00CHUU
Chemical Name:
4-(4-Bromophenoxy)benzonitrile
CAS Number:
330792-93-3
Molecular Formula:
C13H8BrNO
Molecular Weight:
274.1127
MDL Number:
MFCD08446949
SMILES:
N#Cc1ccc(cc1)Oc1ccc(cc1)Br
Properties
Properties
 
BP:
369.9±22.0 °C(Predicted)  
Form:
Solid  
MP:
78-79 °C  
Storage:
Room Temperature;  

Computed Properties
 
Complexity:
256  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
2  
XLogP3:
3.9  

Downstream Synthesis Route

[1]CurrentPatentAssignee:PFIZERINC-US2007/293457,2007,A1Locationinpatent:Page/Pagecolumn47

[2]CurrentPatentAssignee:PFIZERINC-US2015/291629,2015,A1Locationinpatent:Paragraph0606

[3]Locationinpatent:experimentalpartLi,Bing;Pai,Ramdas;Cardinale,StevenC.;Butler,MichelleM.;Peet,NortonP.;Moir,DonaldT.;Bavari,Sina;Bowlin,TerryL.[JournalofMedicinalChemistry,2010,vol.53,#5,p.2264-2276]

[4]CurrentPatentAssignee:SHENZHENDONGYANGGUANGINDUSTRIALDEVELOPMENTCOLTD-CN109111451,2019,ALocationinpatent:Paragraph1111;1112;1113;1114

[5]CurrentPatentAssignee:SHENZHENDONGYANGGUANGINDUSTRIALDEVELOPMENTCOLTD-WO2019/1396,2019,A1Locationinpatent:Paragraph00418

[6]CurrentPatentAssignee:GUANGZHOUINNOCAREPHARMATECH-WO2015/48662,2015,A2Locationinpatent:Page/Pagecolumn66

[7]Dey,Archan;Desiraju,GautamR.[ChemicalCommunications,2005,#19,p.2486-2488]

[8]CurrentPatentAssignee:ABBVIEINC-US2002/156081,2002,A1

[9]CurrentPatentAssignee:ABBVIEINC-US6921763,2005,B2

[10]Lele,ArundhatiC.;Raju,Archana;Khambete,MihirP.;Ray;Rajan;Arkile,ManishaA.;Jadhav,NandadeepJ.;Sarkar,Dhiman;Degani,MariamS.[ACSMedicinalChemistryLetters,2015,vol.6,#11,p.1140-1144]

[1]JournalofMedicinalChemistry,2010,vol.53,p.2264-2276

[1]Wang,Hailei;Yu,Ajuan;Cao,Aijuan;Chang,Junbiao;Wu,Yangjie[AppliedOrganometallicChemistry,2013,vol.27,#10,p.611-614]

[2]Chen,Jiuxi;Wang,Xingyong;Zheng,Xingwang;Ding,Jinchang;Liu,Miaochang;Wu,Huayue[Tetrahedron,2012,vol.68,#43,p.8905-8907]

330792-93-3    16886-09-2   
C24H18N2O 

[1]CurrentPatentAssignee:PURDUEPHARMAL.P.-US2013/296281,2013,A1Locationinpatent:Paragraph0529

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Tags:330792-93-3 Molecular Formula|330792-93-3 MDL|330792-93-3 SMILES|330792-93-3 4-(4-Bromophenoxy)benzonitrile