CAS 103836-45-9 | 2H-Benz[f]isoindole-1-carbonitrile | CAS Number 103836-45-9

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103836-45-9 | 2H-Benz[f]isoindole-1-carbonitrile

CAS No: 103836-45-9 Catalog No: AG007X3H MDL No:

Product Description

Catalog Number:

AG007X3H

Chemical Name:

2H-Benz[f]isoindole-1-carbonitrile

CAS Number:

103836-45-9

Molecular Formula:

C13H8N2

Molecular Weight:

192.2160

IUPAC Name:

2H-benzo[f]isoindole-3-carbonitrile

InChI:

InChI=1S/C13H8N2/c14-7-13-12-6-10-4-2-1-3-9(10)5-11(12)8-15-13/h1-6,8,15H

InChI Key:

OLVUIXNBDVBFJI-UHFFFAOYSA-N

SMILES:

N#Cc1[nH]cc2c1cc1ccccc1c2

Properties

Complexity:

290

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

192.069g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

192.221g/mol

Monoisotopic Mass:

192.069g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

39.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.3

Literature

Title	Journal
Optimization of the separation of NDA-derivatized methylarginines by capillary and microchip electrophoresis.	Journal of laboratory automation 20120201
New high-performance liquid chromatographic method for sensitive determination of pheomelanin in biological materials by precolumn fluorescence derivatization with naphthalene-2,3-dicarboxaldehyde.	Journal of chromatography. A 20070330
Enantioseparation and stacking of Cyanobenz[f]isoindole-amino acids by reverse polarity capillary electrophoresis and sulfated beta-cyclodextrin.	Analytical chemistry 20070115
Spectrofluorimetric determination of tranexamic acid in hydrogel patch formulations by derivatization with naphthalene-2,3-dicarboxaldehyde/cyanide.	Journal of cosmetic science 20070101
Quantitative analysis of a model opioid peptide and its cyclic prodrugs in rat plasma using high-performance liquid chromatography with fluorescence and tandem mass spectrometric detection.	Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20021125