Home Nitriles 2-Benzofurancarbonitrile, 5-methyl-

2-Benzofurancarbonitrile, 5-methyl-

CAS No.:
35351-43-0
Catalog Number:
AG00CPG0
Molecular Formula:
C10H7NO
Molecular Weight:
157.1687
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Product Description
Catalog Number:
AG00CPG0
Chemical Name:
2-Benzofurancarbonitrile, 5-methyl-
CAS Number:
35351-43-0
Molecular Formula:
C10H7NO
Molecular Weight:
157.1687
MDL Number:
MFCD11574554
IUPAC Name:
5-methyl-1-benzofuran-2-carbonitrile
InChI:
InChI=1S/C10H7NO/c1-7-2-3-10-8(4-7)5-9(6-11)12-10/h2-5H,1H3
InChI Key:
KFUGKHCNRKHFLN-UHFFFAOYSA-N
SMILES:
N#Cc1cc2c(o1)ccc(c2)C
Properties
Complexity:
217  
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:
0
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties