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210-86-6 | 1H-Furo[3,4-e]benzimidazole (9CI)
CAS No: 210-86-6 Catalog No: AG002KIM MDL No:
Product Description
Catalog Number:
AG002KIM
Chemical Name:
1H-Furo[3,4-e]benzimidazole (9CI)
CAS Number:
210-86-6
Molecular Formula:
C9H6N2O
Molecular Weight:
158.1567
IUPAC Name:
3H-furo[3,4-e]benzimidazole
InChI:
InChI=1S/C9H6N2O/c1-2-8-9(11-5-10-8)7-4-12-3-6(1)7/h1-5H,(H,10,11)
InChI Key:
AMLAJYKJAOJANG-UHFFFAOYSA-N
SMILES:
o1cc2c(c1)c1[nH]cnc1cc2
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.048g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
158.16g/mol
Monoisotopic Mass:
158.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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