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95333-17-8 | Benzofuran-4-carbonitrile
CAS No: 95333-17-8 Catalog No: AG003O26 MDL No:MFCD10699413
Product Description
Catalog Number:
AG003O26
Chemical Name:
Benzofuran-4-carbonitrile
CAS Number:
95333-17-8
Molecular Formula:
C9H5NO
Molecular Weight:
143.1421
MDL Number:
MFCD10699413
IUPAC Name:
1-benzofuran-4-carbonitrile
InChI:
InChI=1S/C9H5NO/c10-6-7-2-1-3-9-8(7)4-5-11-9/h1-5H
InChI Key:
VCQONKRSTAUGEP-UHFFFAOYSA-N
SMILES:
N#Cc1cccc2c1cco2
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.037g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
143.145g/mol
Monoisotopic Mass:
143.037g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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