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Home > Imidazoles > 137654-47-8
137654-47-8 | Formamide, N-1H-benzimidazol-7-yl-
CAS No: 137654-47-8 Catalog No: AG0013OC MDL No:MFCD20667048
Product Description
Catalog Number:
AG0013OC
Chemical Name:
Formamide, N-1H-benzimidazol-7-yl-
CAS Number:
137654-47-8
Molecular Formula:
C8H7N3O
Molecular Weight:
161.1607
MDL Number:
MFCD20667048
IUPAC Name:
N-(1H-benzimidazol-4-yl)formamide
InChI:
InChI=1S/C8H7N3O/c12-5-11-7-3-1-2-6-8(7)10-4-9-6/h1-5H,(H,9,10)(H,11,12)
InChI Key:
LGITZGIQYPDWBF-UHFFFAOYSA-N
SMILES:
O=CNc1cccc2c1[nH]cn2
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.059g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
161.164g/mol
Monoisotopic Mass:
161.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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