Home Nitriles 1-Benzofuran-3-ylacetonitrile

1-Benzofuran-3-ylacetonitrile

CAS No.:
52407-43-9
Catalog Number:
AG003DYZ
Molecular Formula:
C10H7NO
Molecular Weight:
157.1687
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Product Description
Catalog Number:
AG003DYZ
Chemical Name:
1-Benzofuran-3-ylacetonitrile
CAS Number:
52407-43-9
Molecular Formula:
C10H7NO
Molecular Weight:
157.1687
MDL Number:
MFCD02183555
IUPAC Name:
2-(1-benzofuran-3-yl)acetonitrile
InChI:
InChI=1S/C10H7NO/c11-6-5-8-7-12-10-4-2-1-3-9(8)10/h1-4,7H,5H2
InChI Key:
BJAJKVZABJZXDC-UHFFFAOYSA-N
SMILES:
N#CCc1coc2c1cccc2
Properties
Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.053g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
157.172g/mol
Monoisotopic Mass:
157.053g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties