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5955-74-8,MFCD06658475
Catalog No.:AA00E9OD

5955-74-8 | 3-Methylbenzoyl cyanide

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Purity
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Price(USD)
Quantity
  
250mg
≥ 98% (NMR)
in stock  
$192.00   $134.00
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  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00E9OD
Chemical Name:
3-Methylbenzoyl cyanide
CAS Number:
5955-74-8
Molecular Formula:
C9H7NO
Molecular Weight:
145.1580
MDL Number:
MFCD06658475
SMILES:
CC1=CC=CC(=C1)C(=O)C#N
Properties
Properties
 
BP:
243.0±19.0°C at 760 mmHg  
Form:
Solid  
MP:
30℃  

Computed Properties
 
Complexity:
201  
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:US6359156,2002,B1,.Locationinpatent:Pagecolumn10

Literature
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SDS
Tags:5955-74-8 Molecular Formula|5955-74-8 MDL|5955-74-8 SMILES|5955-74-8 3-Methylbenzoyl cyanide