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Home > Nitro Compounds > 146583-34-8
146583-34-8 | Benzene, 1-(dodecyloxy)-4-[2-(4-nitrophenyl)ethenyl]-
CAS No: 146583-34-8 Catalog No: AG001E5C MDL No:
Product Description
Catalog Number:
AG001E5C
Chemical Name:
Benzene, 1-(dodecyloxy)-4-[2-(4-nitrophenyl)ethenyl]-
CAS Number:
146583-34-8
Molecular Formula:
C26H35NO3
Molecular Weight:
409.5610
IUPAC Name:
1-[2-(4-dodecoxyphenyl)ethenyl]-4-nitrobenzene
InChI:
InChI=1S/C26H35NO3/c1-2-3-4-5-6-7-8-9-10-11-22-30-26-20-16-24(17-21-26)13-12-23-14-18-25(19-15-23)27(28)29/h12-21H,2-11,22H2,1H3
InChI Key:
JHMRVCBQMQGAPJ-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCOc1ccc(cc1)C=Cc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
457
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
409.262g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
409.57g/mol
Monoisotopic Mass:
409.262g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
9.6
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