Home Nitriles 3-methoxy-1-benzofuran-2-carbonitrile

3-methoxy-1-benzofuran-2-carbonitrile

CAS No.:
84748-24-3
Catalog Number:
AG01AD2R
Molecular Formula:
C10H7NO2
Molecular Weight:
173.1681
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Product Description
Catalog Number:
AG01AD2R
Chemical Name:
3-methoxy-1-benzofuran-2-carbonitrile
CAS Number:
84748-24-3
Molecular Formula:
C10H7NO2
Molecular Weight:
173.1681
MDL Number:
MFCD26862754
IUPAC Name:
3-methoxy-1-benzofuran-2-carbonitrile
InChI:
InChI=1S/C10H7NO2/c1-12-10-7-4-2-3-5-8(7)13-9(10)6-11/h2-5H,1H3
InChI Key:
XBDZBBPLAYCOTH-UHFFFAOYSA-N
SMILES:
N#Cc1oc2c(c1OC)cccc2
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:
2.3  
Properties