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14064-72-3 | Benzenamine, N,N-dimethyl-4-[(1Z)-2-(4-nitrophenyl)ethenyl]-
CAS No: 14064-72-3 Catalog No: AG001CMK MDL No:
Product Description
Catalog Number:
AG001CMK
Chemical Name:
Benzenamine, N,N-dimethyl-4-[(1Z)-2-(4-nitrophenyl)ethenyl]-
CAS Number:
14064-72-3
Molecular Formula:
C16H16N2O2
Molecular Weight:
268.3104
IUPAC Name:
N,N-dimethyl-4-[2-(4-nitrophenyl)ethenyl]aniline
InChI:
InChI=1S/C16H16N2O2/c1-17(2)15-9-5-13(6-10-15)3-4-14-7-11-16(12-8-14)18(19)20/h3-12H,1-2H3
InChI Key:
NVLSIZITFJRWPY-UHFFFAOYSA-N
SMILES:
CN(c1ccc(cc1)/C=C\c1ccc(cc1)[N+](=O)[O-])C
Properties
Complexity:
333
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.121g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.316g/mol
Monoisotopic Mass:
268.121g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.5
Literature
| Title | Journal |
|---|---|
| Theoretical investigation on the effect of protonation on the absorption and emission spectra of two amine-group-bearing, red 'push-pull' emitters, 4-dimethylamino-4'-nitrostilbene and 4-(dicyanomethylene)-2-methyl-6-p-(dimethylamino) styryl-4H-pyran, by DFT and TDDFT calculations. | The journal of physical chemistry. A 20100506 |
| Photochemically-induced acid generation from 18-molybdodiphosphate and 18-tungstodiphosphate within poly(2-hydroxyethyl methacrylate) films. | Inorganic chemistry 20090601 |
| Photoexcited triplets of dyes in zeolitic nanostructured channels. A time resolved EPR study. | Physical chemistry chemical physics : PCCP 20061121 |
| Photoinduced single- versus double-bond torsion in donor-acceptor-substituted trans-stilbenes. | The journal of physical chemistry. A 20060706 |
| External electric field effects on state energy and photoexcitation dynamics of diphenylpolyenes. | Journal of the American Chemical Society 20050518 |
| The photochemical characteristics of aromatic enediyne compounds substituted with electron donating and electron withdrawing groups. | Organic & biomolecular chemistry 20030807 |
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