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Home > Nitro Compounds > 89266-64-8
89266-64-8 | Benzofuran, 2-(2-furanyl)-5-nitro-
CAS No: 89266-64-8 Catalog No: AG0041G8 MDL No:
Product Description
Catalog Number:
AG0041G8
Chemical Name:
Benzofuran, 2-(2-furanyl)-5-nitro-
CAS Number:
89266-64-8
Molecular Formula:
C12H7NO4
Molecular Weight:
229.1883
IUPAC Name:
2-(furan-2-yl)-5-nitro-1-benzofuran
InChI:
InChI=1S/C12H7NO4/c14-13(15)9-3-4-10-8(6-9)7-12(17-10)11-2-1-5-16-11/h1-7H
InChI Key:
IIXNXFBUBFQUMA-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)cc(o2)c1ccco1
Properties
Complexity:
303
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.038g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.191g/mol
Monoisotopic Mass:
229.038g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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