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Home > Imidazoles > 93972-55-5
93972-55-5 | 1H-Imidazole, 4-phenyl-5-(2-thienyl)-
CAS No: 93972-55-5 Catalog No: AG006AEX MDL No:
Product Description
Catalog Number:
AG006AEX
Chemical Name:
1H-Imidazole, 4-phenyl-5-(2-thienyl)-
CAS Number:
93972-55-5
Molecular Formula:
C13H10N2S
Molecular Weight:
226.2969
IUPAC Name:
4-phenyl-5-thiophen-2-yl-1H-imidazole
InChI:
InChI=1S/C13H10N2S/c1-2-5-10(6-3-1)12-13(15-9-14-12)11-7-4-8-16-11/h1-9H,(H,14,15)
InChI Key:
WCVIRLVKADQCFG-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)c1nc[nH]c1c1cccs1
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.056g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
226.297g/mol
Monoisotopic Mass:
226.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
56.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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