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148194-18-7 | 1H-Thieno[2,3-e]benzimidazole (9CI)
CAS No: 148194-18-7 Catalog No: AG001FJ0 MDL No:MFCD18810576
Product Description
Catalog Number:
AG001FJ0
Chemical Name:
1H-Thieno[2,3-e]benzimidazole (9CI)
CAS Number:
148194-18-7
Molecular Formula:
C9H6N2S
Molecular Weight:
174.2223
MDL Number:
MFCD18810576
IUPAC Name:
3H-thieno[2,3-e]benzimidazole
InChI:
InChI=1S/C9H6N2S/c1-2-7-8(11-5-10-7)9-6(1)3-4-12-9/h1-5H,(H,10,11)
InChI Key:
UJKJCIUZMSPVCX-UHFFFAOYSA-N
SMILES:
c1cc2c(s1)c1[nH]cnc1cc2
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.025g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
174.221g/mol
Monoisotopic Mass:
174.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
56.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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