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Home > Imidazoles > 4110-12-7
4110-12-7 | 2-(Methylthio)-5,5-diphenyl-2-imidazoline-4-thione
CAS No: 4110-12-7 Catalog No: AG00D608 MDL No:
Product Description
Catalog Number:
AG00D608
Chemical Name:
2-(Methylthio)-5,5-diphenyl-2-imidazoline-4-thione
CAS Number:
4110-12-7
IUPAC Name:
2-methylsulfanyl-4,4-diphenyl-1H-imidazole-5-thione
InChI:
InChI=1S/C16H14N2S2/c1-20-15-17-14(19)16(18-15,12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11H,1H3,(H,17,18,19)
InChI Key:
FJKOPIQLHKSATF-UHFFFAOYSA-N
Properties
Complexity:
375
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.06g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
298.422g/mol
Monoisotopic Mass:
298.06g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
81.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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