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Home > Imidazoles > 67947-42-6
67947-42-6 | 4,5-bis(thiophen-2-yl)-1H-imidazole-2-thiol
CAS No: 67947-42-6 Catalog No: AG019JTN MDL No:MFCD06358025
Product Description
Catalog Number:
AG019JTN
Chemical Name:
4,5-bis(thiophen-2-yl)-1H-imidazole-2-thiol
CAS Number:
67947-42-6
Molecular Formula:
C11H8N2S3
Molecular Weight:
264.3896
MDL Number:
MFCD06358025
IUPAC Name:
4,5-dithiophen-2-yl-1,3-dihydroimidazole-2-thione
InChI:
InChI=1S/C11H8N2S3/c14-11-12-9(7-3-1-5-15-7)10(13-11)8-4-2-6-16-8/h1-6H,(H2,12,13,14)
InChI Key:
ODBUBIMVCRYBKS-UHFFFAOYSA-N
SMILES:
Sc1[nH]c(c(n1)c1cccs1)c1cccs1
Properties
Complexity:
310
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.985g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
264.379g/mol
Monoisotopic Mass:
263.985g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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