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Home > Imidazoles > 1105188-73-5
1105188-73-5 | 1,5-Bis(4-methylphenyl)-1H-imidazole-2-thiol
CAS No: 1105188-73-5 Catalog No: AG01ARW4 MDL No:MFCD11986814
Product Description
Catalog Number:
AG01ARW4
Chemical Name:
1,5-Bis(4-methylphenyl)-1H-imidazole-2-thiol
CAS Number:
1105188-73-5
Molecular Formula:
C17H16N2S
Molecular Weight:
280.3873
MDL Number:
MFCD11986814
IUPAC Name:
3,4-bis(4-methylphenyl)-1H-imidazole-2-thione
InChI:
InChI=1S/C17H16N2S/c1-12-3-7-14(8-4-12)16-11-18-17(20)19(16)15-9-5-13(2)6-10-15/h3-11H,1-2H3,(H,18,20)
InChI Key:
VCORWRWJRSGBTH-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)n1c(S)ncc1c1ccc(cc1)C
Properties
Complexity:
388
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.103g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
280.389g/mol
Monoisotopic Mass:
280.103g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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