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Home > Nitro Compounds > 116539-72-1
116539-72-1 | Pyridine, 2,6-bis[2-(4-nitrophenyl)ethenyl]-
CAS No: 116539-72-1 Catalog No: AG000CR4 MDL No:
Product Description
Catalog Number:
AG000CR4
Chemical Name:
Pyridine, 2,6-bis[2-(4-nitrophenyl)ethenyl]-
CAS Number:
116539-72-1
Molecular Formula:
C21H15N3O4
Molecular Weight:
373.3615
IUPAC Name:
2,6-bis[2-(4-nitrophenyl)ethenyl]pyridine
InChI:
InChI=1S/C21H15N3O4/c25-23(26)20-12-6-16(7-13-20)4-10-18-2-1-3-19(22-18)11-5-17-8-14-21(15-9-17)24(27)28/h1-15H
InChI Key:
RMQKLRRIKWGEHU-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)C=Cc1cccc(n1)C=Cc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
529
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
373.106g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
373.368g/mol
Monoisotopic Mass:
373.106g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
5.1
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