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Home > Nitro Compounds > 26104-33-6
26104-33-6 | Pyrene, 1-[2-(4-nitrophenyl)ethenyl]-
CAS No: 26104-33-6 Catalog No: AG002RP0 MDL No:
Product Description
Catalog Number:
AG002RP0
Chemical Name:
Pyrene, 1-[2-(4-nitrophenyl)ethenyl]-
CAS Number:
26104-33-6
Molecular Formula:
C24H15NO2
Molecular Weight:
349.3814
IUPAC Name:
1-[2-(4-nitrophenyl)ethenyl]pyrene
InChI:
InChI=1S/C24H15NO2/c26-25(27)21-13-5-16(6-14-21)4-7-17-8-9-20-11-10-18-2-1-3-19-12-15-22(17)24(20)23(18)19/h1-15H
InChI Key:
WMOISLUWKUUCGF-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)C=Cc1ccc2c3c1ccc1c3c(cc2)ccc1
Properties
Complexity:
573
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.11g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
349.389g/mol
Monoisotopic Mass:
349.11g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
7.1
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