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Home > Imidazoles > 439085-88-8
439085-88-8 | 1H-Benzimidazol-5-ol,2-(ethylthio)-(9CI)
CAS No: 439085-88-8 Catalog No: AG00DWKL MDL No:
Product Description
Catalog Number:
AG00DWKL
Chemical Name:
1H-Benzimidazol-5-ol,2-(ethylthio)-(9CI)
CAS Number:
439085-88-8
IUPAC Name:
2-ethylsulfanyl-3H-benzimidazol-5-ol
InChI:
InChI=1S/C9H10N2OS/c1-2-13-9-10-7-4-3-6(12)5-8(7)11-9/h3-5,12H,2H2,1H3,(H,10,11)
InChI Key:
ZQBDQTSBJMYKAW-UHFFFAOYSA-N
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.051g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
194.252g/mol
Monoisotopic Mass:
194.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
74.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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