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Home > Imidazoles > 850786-33-3
850786-33-3 | Benzonitrile, 4-(4,5-dihydro-1H-imidazol-2-yl)-
CAS No: 850786-33-3 Catalog No: AG00GCDN MDL No:MFCD16877945
Product Description
Catalog Number:
AG00GCDN
Chemical Name:
Benzonitrile, 4-(4,5-dihydro-1H-imidazol-2-yl)-
CAS Number:
850786-33-3
MDL Number:
MFCD16877945
IUPAC Name:
4-(4,5-dihydro-1H-imidazol-2-yl)benzonitrile
InChI:
InChI=1S/C10H9N3/c11-7-8-1-3-9(4-2-8)10-12-5-6-13-10/h1-4H,5-6H2,(H,12,13)
InChI Key:
QSYOBRLVRMIBRU-UHFFFAOYSA-N
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.08g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
171.203g/mol
Monoisotopic Mass:
171.08g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
48.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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