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Home > Imidazoles > 1105191-79-4
1105191-79-4 | 5-(4-METHOXYPHENYL)-1-(3-METHYLPHENYL)-1H-IMIDAZOLE-2-THIOL
CAS No: 1105191-79-4 Catalog No: AG01AQBF MDL No:MFCD16653112
Product Description
Catalog Number:
AG01AQBF
Chemical Name:
5-(4-METHOXYPHENYL)-1-(3-METHYLPHENYL)-1H-IMIDAZOLE-2-THIOL
CAS Number:
1105191-79-4
MDL Number:
MFCD16653112
IUPAC Name:
4-(4-methoxyphenyl)-3-(3-methylphenyl)-1H-imidazole-2-thione
InChI:
InChI=1S/C17H16N2OS/c1-12-4-3-5-14(10-12)19-16(11-18-17(19)21)13-6-8-15(20-2)9-7-13/h3-11H,1-2H3,(H,18,21)
InChI Key:
JMKBOVVAGGBSQV-UHFFFAOYSA-N
Properties
Complexity:
415
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.098g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
296.388g/mol
Monoisotopic Mass:
296.098g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
56.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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