Home Other Building Blocks 4-METHOXY-1-BENZOFURAN-7-CARBONITRILE

4-METHOXY-1-BENZOFURAN-7-CARBONITRILE

CAS No.:
1258959-97-5
Catalog Number:
AG01DST3
Molecular Formula:
C10H7NO2
Molecular Weight:
173.1681
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Product Description
Catalog Number:
AG01DST3
Chemical Name:
4-METHOXY-1-BENZOFURAN-7-CARBONITRILE
CAS Number:
1258959-97-5
Molecular Formula:
C10H7NO2
Molecular Weight:
173.1681
MDL Number:
MFCD23705133
IUPAC Name:
4-methoxy-1-benzofuran-7-carbonitrile
InChI:
InChI=1S/C10H7NO2/c1-12-9-3-2-7(6-11)10-8(9)4-5-13-10/h2-5H,1H3
InChI Key:
ZNVQXGZORDEGLK-UHFFFAOYSA-N
SMILES:
COc1ccc(c2c1cco2)C#N
Properties
Complexity:
232  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.048g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.171g/mol
Monoisotopic Mass:
173.048g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties