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Home > Imidazoles > 58261-91-9
58261-91-9 | (5-METHYL-2-PHENYL-1H-IMIDAZOL-4-YL)-ACETONITRILE
CAS No: 58261-91-9 Catalog No: AG00EFJO MDL No:MFCD00868230
Product Description
Catalog Number:
AG00EFJO
Chemical Name:
(5-METHYL-2-PHENYL-1H-IMIDAZOL-4-YL)-ACETONITRILE
CAS Number:
58261-91-9
MDL Number:
MFCD00868230
IUPAC Name:
2-(5-methyl-2-phenyl-1H-imidazol-4-yl)acetonitrile
InChI:
InChI=1S/C12H11N3/c1-9-11(7-8-13)15-12(14-9)10-5-3-2-4-6-10/h2-6H,7H2,1H3,(H,14,15)
InChI Key:
OTRQRKIYHATFKM-UHFFFAOYSA-N
UNII:
74WY8560J7
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.095g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
197.241g/mol
Monoisotopic Mass:
197.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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