Home Nitriles 3-(5-Formylfuran-2-yl)benzonitrile

3-(5-Formylfuran-2-yl)benzonitrile

CAS No.:
647023-96-9
Catalog Number:
AG01EWS8
Molecular Formula:
C12H7NO2
Molecular Weight:
197.1895
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
1 week
United States
$607
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Product Description
Catalog Number:
AG01EWS8
Chemical Name:
3-(5-Formylfuran-2-yl)benzonitrile
CAS Number:
647023-96-9
Molecular Formula:
C12H7NO2
Molecular Weight:
197.1895
MDL Number:
MFCD06740259
IUPAC Name:
3-(5-formylfuran-2-yl)benzonitrile
InChI:
InChI=1S/C12H7NO2/c13-7-9-2-1-3-10(6-9)12-5-4-11(8-14)15-12/h1-6,8H
InChI Key:
WWIBKMSNYPHZIK-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(o1)c1cccc(c1)C#N
Properties
Complexity:
281  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.048g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.193g/mol
Monoisotopic Mass:
197.048g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties