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6488-88-6 | 1H-Benzimidazole,2-(1H-pyrazol-1-yl)-(9CI)
CAS No: 6488-88-6 Catalog No: AG00EWFA MDL No:MFCD18807525
Product Description
Catalog Number:
AG00EWFA
Chemical Name:
1H-Benzimidazole,2-(1H-pyrazol-1-yl)-(9CI)
CAS Number:
6488-88-6
Molecular Formula:
C10H8N4
Molecular Weight:
184.1973
MDL Number:
MFCD18807525
IUPAC Name:
2-pyrazol-1-yl-1H-benzimidazole
InChI:
InChI=1S/C10H8N4/c1-2-5-9-8(4-1)12-10(13-9)14-7-3-6-11-14/h1-7H,(H,12,13)
InChI Key:
QMKRHMVAGXMKAA-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)[nH]c(n2)n1cccn1
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.075g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
184.202g/mol
Monoisotopic Mass:
184.075g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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