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167993-16-0 | 1H-Furo[3,4-f]benzimidazole-5,7-dione
CAS No: 167993-16-0 Catalog No: AG001XQA MDL No:
Product Description
Catalog Number:
AG001XQA
Chemical Name:
1H-Furo[3,4-f]benzimidazole-5,7-dione
CAS Number:
167993-16-0
Molecular Formula:
C9H4N2O3
Molecular Weight:
188.1397
IUPAC Name:
3H-furo[3,4-f]benzimidazole-5,7-dione
InChI:
InChI=1S/C9H4N2O3/c12-8-4-1-6-7(11-3-10-6)2-5(4)9(13)14-8/h1-3H,(H,10,11)
InChI Key:
LSJKEARWMQPUEK-UHFFFAOYSA-N
SMILES:
O=C1OC(=O)c2c1cc1[nH]cnc1c2
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.022g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
188.142g/mol
Monoisotopic Mass:
188.022g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
72A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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