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3945-78-6 | 2-(5-nitro-2-furyl)-1H-benzoimidazole
CAS No: 3945-78-6 Catalog No: AG00CJWD MDL No:
Product Description
Catalog Number:
AG00CJWD
Chemical Name:
2-(5-nitro-2-furyl)-1H-benzoimidazole
CAS Number:
3945-78-6
IUPAC Name:
2-(5-nitrofuran-2-yl)-1H-benzimidazole
InChI:
InChI=1S/C11H7N3O3/c15-14(16)10-6-5-9(17-10)11-12-7-3-1-2-4-8(7)13-11/h1-6H,(H,12,13)
InChI Key:
GOUDVMWLWAFVMC-UHFFFAOYSA-N
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.049g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.195g/mol
Monoisotopic Mass:
229.049g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
87.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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