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Home > Nitro Compounds > 89266-51-3
89266-51-3 | Benzofuran, 5-methoxy-2-[2-(5-nitro-2-furanyl)ethenyl]-
CAS No: 89266-51-3 Catalog No: AG0041TS MDL No:
Product Description
Catalog Number:
AG0041TS
Chemical Name:
Benzofuran, 5-methoxy-2-[2-(5-nitro-2-furanyl)ethenyl]-
CAS Number:
89266-51-3
Molecular Formula:
C15H11NO5
Molecular Weight:
285.2515
IUPAC Name:
5-methoxy-2-[2-(5-nitrofuran-2-yl)ethenyl]-1-benzofuran
InChI:
InChI=1S/C15H11NO5/c1-19-12-4-6-14-10(8-12)9-13(20-14)3-2-11-5-7-15(21-11)16(17)18/h2-9H,1H3
InChI Key:
LELOEIRXUKBLQW-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)cc(o2)C=Cc1ccc(o1)[N+](=O)[O-]
Properties
Complexity:
407
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.064g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.255g/mol
Monoisotopic Mass:
285.064g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
81.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.9
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