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873-74-5,MFCD00007821
Catalog No.:AA0033XT

873-74-5 | 4-Aminobenzonitrile

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25g
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  • Technical Information
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA0033XT
Chemical Name:
4-Aminobenzonitrile
CAS Number:
873-74-5
Molecular Formula:
C7H6N2
Molecular Weight:
118.1359
MDL Number:
MFCD00007821
SMILES:
N#Cc1ccc(cc1)N
NSC Number:
7625
Properties
Properties
 
BP:
286.5°C at 760 mmHg  
Form:
Solid  
MP:
83-85 °C(lit.)  
Refractive Index:
1.5500 (estimate)  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
125  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
XLogP3:
1.3  

Literature

Title: Solute-solvent hydrogen-bonding in room temperature ionic liquids studied by Raman spectroscopy.

Journal: Physical chemistry chemical physics : PCCP 20121021

Title: 4-Cyano-anilinium bromide.

Journal: Acta crystallographica. Section E, Structure reports online 20121001

Title: 4-Cyano-anilinium iodide.

Journal: Acta crystallographica. Section E, Structure reports online 20120901

Title: Preparation of a family of hexanuclear rhenium cluster complexes containing 5-(phenyl)tetrazol-2-yl ligands and alkylation of 5-substituted tetrazolate ligands.

Journal: Inorganic chemistry 20120716

Title: 2-(4-Amino-phen-yl)-3,4,5,6-tetra-hydro-pyrimidin-1-ium chloride.

Journal: Acta crystallographica. Section E, Structure reports online 20120501

Title: (E)-4-[(4-Diethyl-amino-2-hy-droxy-benzyl-idene)amino]-benzonitrile.

Journal: Acta crystallographica. Section E, Structure reports online 20120301

Title: Imidazolines as non-classical bioisosteres of N-acyl homoserine lactones and quorum sensing inhibitors.

Journal: International journal of molecular sciences 20120101

Title: Microwave assisted synthesis and determination of in-vitro antimicrobial efficacy of well characterized s-triazinyl piperazines and piperidines.

Journal: Acta poloniae pharmaceutica 20120101

Title: Bis[2-(4-amino-phen-yl)-4,5-dihydro-1H-imidazol-3-ium] dichloride monohydrate.

Journal: Acta crystallographica. Section E, Structure reports online 20111201

Title: Incorporating peptides in the outer-coordination sphere of bioinspired electrocatalysts for hydrogen production.

Journal: Inorganic chemistry 20110502

Title: N-(4-Cyano-phen-yl)-2,6-difluoro-benzamide.

Journal: Acta crystallographica. Section E, Structure reports online 20101201

Title: 4-Amino-benzoic acid-4,4'-(propane-1,3-diyl)dipyridine (1/1).

Journal: Acta crystallographica. Section E, Structure reports online 20101101

Title: 4-Amino-benzoic acid-1,2-bis-(4-pyrid-yl)ethane (2/1).

Journal: Acta crystallographica. Section E, Structure reports online 20100701

Title: 4-[2-(2,2-Dimethyl-4,6-dioxo-1,3-dioxan-5-yl-idene)hydrazin-1-yl]benzo-nitrile.

Journal: Acta crystallographica. Section E, Structure reports online 20100701

Title: Investigating the mechanisms of aromatic amine-induced protein free radical formation by quantitative structure-activity relationships: implications for drug-induced agranulocytosis.

Journal: Chemical research in toxicology 20100517

Title: Self-structured surface patterns on molecular azo glass films induced by laser light irradiation.

Journal: Langmuir : the ACS journal of surfaces and colloids 20100504

Title: Aqueous solvation of p-aminobenzonitrile in the excited states: a molecular level theory on density dependence.

Journal: The journal of physical chemistry. B 20100121

Title: (E)-4-[4-(Dimethyl-amino)benzyl-ideneamino]benzonitrile.

Journal: Acta crystallographica. Section E, Structure reports online 20091201

Title: Analysis of N-acetylaminosugars by CE: a comparative derivatization study.

Journal: Electrophoresis 20090801

Title: 1-(4-Cyano-phenyl-diazen-2-ium-1-yl)-2-naphtholate.

Journal: Acta crystallographica. Section E, Structure reports online 20090801

Title: Raman spectroscopic study on the solvation of p-aminobenzonitrile in supercritical water and methanol.

Journal: The journal of physical chemistry. A 20090402

Title: A new approach to aid the characterisation and identification of metabolites of a model drug; partial isotope enrichment combined with novel formula elucidation software.

Journal: Rapid communications in mass spectrometry : RCM 20090101

Title: Protolytic dissociation of cyanoanilines in the ground and excited state in water and methanol solutions.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20081115

Title: 4-Cyano-anilinium perchlorate.

Journal: Acta crystallographica. Section E, Structure reports online 20081001

Title: 4-(2-Hydroxy-benzyl-idene-amino)-benzonitrile.

Journal: Acta crystallographica. Section E, Structure reports online 20080701

Title: The low-lying pisigma* state and its role in the intramolecular charge transfer of aminobenzonitriles and aminobenzethyne.

Journal: The Journal of chemical physics 20080428

Title: 4-(4-Hydroxy-phenyl-diazen-yl)-benzonitrile.

Journal: Acta crystallographica. Section E, Structure reports online 20080301

Title: Triplet state dipole moments of aminobenzonitriles.

Journal: The journal of physical chemistry. A 20080221

Title: Capillary electrophoresis of sugar acids.

Journal: Methods in molecular biology (Clifton, N.J.) 20080101

Title: Ultrafast relaxation and coherent oscillations in aminobenzonitriles in the gas phase probed by intense-field ionization.

Journal: Physical chemistry chemical physics : PCCP 20070314

Title: Cobaloximes as functional models for hydrogenases. 2. Proton electroreduction catalyzed by difluoroborylbis(dimethylglyoximato)cobalt(II) complexes in organic media.

Journal: Inorganic chemistry 20070305

Title: Design and synthesis of an array of selective androgen receptor modulators.

Journal: Journal of combinatorial chemistry 20070101

Title: Theoretical investigation of luminescence behavior as a function of alkyl chain size in 4-aminobenzonitrile alicyclic derivatives.

Journal: The journal of physical chemistry. A 20061012

Title: Recovery of free oligosaccharides from derivatives labeled by reductive amination.

Journal: Analytical biochemistry 20060701

Title: Dynamics of ultrafast intramolecular charge transfer with 4-(dimethylamino)benzonitrile in acetonitrile.

Journal: The journal of physical chemistry. A 20060309

Title: Pendant bases as proton relays in iron hydride and dihydrogen complexes.

Journal: Journal of the American Chemical Society 20060308

Title: Photoproduct formation with 4-aminobenzonitriles in acetonitrile and its effect on photophysical measurements.

Journal: The journal of physical chemistry. A 20051215

Title: Palladium-catalyzed allylation of acidic and less nucleophilic anilines using allylic alcohols directly.

Journal: Chemical & pharmaceutical bulletin 20051001

Title: Molybdenum-sulfur dimers as electrocatalysts for the production of hydrogen at low overpotentials.

Journal: Journal of the American Chemical Society 20050914

Title: Photophysics of aromatic molecules with low-lying pi sigma* states: excitation-energy dependence of fluorescence in jet-cooled aromatic nitriles.

Journal: The journal of physical chemistry. A 20050818

Title: Intramolecular charge transfer in 4-aminobenzonitriles does not necessarily need the twist.

Journal: Journal of the American Chemical Society 20050518

Title: Solvent dependence of the spectra and kinetics of excited-state charge transfer in three (alkylamino)benzonitriles.

Journal: The journal of physical chemistry. B 20050203

Title: Reduced flavin: NMR investigation of N5-H exchange mechanism, estimation of ionisation constants and assessment of properties as biological catalyst.

Journal: BMC biochemistry 20050101

Title: The role of pi sigma* state in intramolecular electron-transfer dynamics of 4-dimethylaminobenzonitrile and related molecules.

Journal: The Journal of chemical physics 20040808

Title: Intramolecular charge transfer with the planarized 4-aminobenzonitrile 1-tert-butyl-6-cyano-1,2,3,4-tetrahydroquinoline (NTC6).

Journal: Journal of the American Chemical Society 20040218

Title: Alkaline degradation kinetics and CE-separation of cello- and xylooligomers. Part I.

Journal: Carbohydrate research 20030523

Title: [Separation of saccharides in tobacco by capillary zone electrophoresis].

Journal: Se pu = Chinese journal of chromatography 20020501

Title: [Effect of para-aminobenzoic acid on the growth of Actinomyces viscosus].

Journal: Hua xi yi ke da xue xue bao = Journal of West China University of Medical Sciences = Huaxi yike daxue xuebao 20020401

Title: [Spectral analysis on self-assembly ultrathin film of polyaminobenzonitrile].

Journal: Guang pu xue yu guang pu fen xi = Guang pu 20010401

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