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Home Carboxes 102151-33-7
102151-33-7,MFCD03093073
Catalog No.:AA0006OF

102151-33-7 | 3-Chloro-4-methoxybenzonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
98%
in stock  
$22.00   $15.00
- +
25g
98%
in stock  
$56.00   $39.00
- +
100g
98%
in stock  
$217.00   $152.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0006OF
Chemical Name:
3-Chloro-4-methoxybenzonitrile
CAS Number:
102151-33-7
Molecular Formula:
C8H6ClNO
Molecular Weight:
167.5923
MDL Number:
MFCD03093073
SMILES:
N#Cc1ccc(c(c1)Cl)OC
Properties
Properties
 
Form:
Solid  
MP:
107-111 °C(lit.)  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
174  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
2.4  

Upstream Synthesis Route

[1]Patent:WO2015/75025,2015,A1,.Locationinpatent:Page/Pagecolumn93

[2]Patent:WO2015/75023,2015,A1,.Locationinpatent:Page/Pagecolumn139

[1]JournalofMedicinalChemistry,1986,vol.29,#6,p.1065-1080

[2]Patent:US4642311,1987,A,

[3]Patent:US4853383,1989,A,

[4]Patent:WO2011/109799,2011,A1,.Locationinpatent:Page/Pagecolumn124

[1]TetrahedronLetters,2016,vol.57,#11,p.1205-1209

[1]ChemicalCommunications,2013,vol.49,#30,p.3146-3148

[1]JournaloftheAmericanChemicalSociety,2017,vol.139,#8,p.2880-2883

Downstream Synthesis Route

[1]JournalofMedicinalChemistry,1986,vol.29,p.1065-1080

[1]JournalofPharmaceuticalSciences,1986,vol.75,p.410-412

[1]JournalofPharmaceuticalSciences,1986,vol.75,p.410-412

[1]JournalofMedicinalChemistry,1986,vol.29,p.1065-1080

[2]Patent:US4642311,1987,A

[3]Patent:US4853383,1989,A

[4]Patent:WO2011/109799,2011,A1.Locationinpatent:Page/Pagecolumn124

[1]JournalofMedicinalChemistry,1997,vol.40,p.1634-1647

Literature
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