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Details

Stereochemistry ACHIRAL
Molecular Formula C8H5NO2
Molecular Weight 147.1308
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-CYANOBENZOIC ACID

SMILES

OC(=O)C1=CC=C(C=C1)C#N

InChI

InChIKey=ADCUEPOHPCPMCE-UHFFFAOYSA-N
InChI=1S/C8H5NO2/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,(H,10,11)

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
The photochemistry of 2-(1-naphthyl)ethyl benzoates: cycloaddition and intramolecular exciplex formation.
2001 May 4
Site distribution in resin beads as determined by confocal Raman spectroscopy.
2001 Sep 17
Inhibitory effect of 4-cyanobenzaldehyde and 4-cyanobenzoic acid on mushroom (Agaricus bisporus) tyrosinase.
2003 Nov
Novel peptidomimetic inhibitors of signal transducer and activator of transcription 3 dimerization and biological activity.
2004 Mar
Evidence against the hopping mechanism as an important electron transfer pathway for conformationally constrained oligopeptides.
2005 Jan 19
Nitroaromatic reduction kinetics as a function of dominant terminal electron acceptor processes in natural sediments.
2006 Apr 1
Crystal structures and magnetic and luminescent properties of a series of homodinuclear lanthanide complexes with 4-cyanobenzoic ligand.
2006 Aug 7
Reduction of diesters of 1,2-diols. Regioselective C-O bond cleavage of the anionic forms.
2006 Jun 23
A hydrogen-bonded heterodimer of 1-(4-hexyloxyphenyl)pyridin-4(1H)-one with 4-cyanobenzoic acid.
2006 Oct
Enantioseparation and stacking of Cyanobenz[f]isoindole-amino acids by reverse polarity capillary electrophoresis and sulfated beta-cyclodextrin.
2007 Jan 15
Synthesis and characterization of CN-modified protein analogues as potential vibrational contrast agents.
2007 Jun
Luminescent gold(I) metallo-acids and their hydrogen bonded supramolecular liquid crystalline derivatives with decyloxystilbazole as hydrogen acceptor.
2008 Dec 28
4-(1H-Tetra-zol-5-yl)benzoic acid monohydrate.
2008 Jun 28
Tuning the framework topologies of Co(II)-doped Zn(II)-tetrazole-benzoate coordination polymers by ligand modifications: structures and spectral studies.
2009 Apr 20
The Diels-Alder-reaction with inverse-electron-demand, a very efficient versatile click-reaction concept for proper ligation of variable molecular partners.
2009 Dec 5
A direct white-light-emitting metal-organic framework with tunable yellow-to-white photoluminescence by variation of excitation light.
2009 Sep 30
Solvent and temperature effects on diastereodifferentiating Paternó-Büchi reaction of chiral alkyl cyanobenzoates with diphenylethene upon direct versus charge-transfer excitation.
2010 Aug 20
Gain of a 500-fold sensitivity on an intravital MR contrast agent based on an endohedral gadolinium-cluster-fullerene-conjugate: a new chance in cancer diagnostics.
2010 May 28
A cyclic-RGD-BioShuttle functionalized with TMZ by DARinv "Click Chemistry" targeted to αvβ3 integrin for therapy.
2010 Sep 21
Patents
Name Type Language
4-CYANOBENZOIC ACID
Systematic Name English
NSC-6306
Code English
P-CYANOBENZOIC ACID
Common Name English
BENZOIC ACID, P-CYANO-
Systematic Name English
4-CARBOXYBENZONITRILE
Systematic Name English
BENZOIC ACID, 4-CYANO-
Systematic Name English
CYANOBENZOIC ACID, 4-
Common Name English
P-CARBOXYBENZONITRILE
Common Name English
CYANOBENZOIC ACID, P-
Common Name English
Classification Tree Code System Code
EPA PESTICIDE CODE 681253
Created by admin on Fri Dec 15 17:58:57 GMT 2023 , Edited by admin on Fri Dec 15 17:58:57 GMT 2023
Code System Code Type Description
NSC
6306
Created by admin on Fri Dec 15 17:58:57 GMT 2023 , Edited by admin on Fri Dec 15 17:58:57 GMT 2023
PRIMARY
CAS
619-65-8
Created by admin on Fri Dec 15 17:58:57 GMT 2023 , Edited by admin on Fri Dec 15 17:58:57 GMT 2023
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FDA UNII
50Z9A3423Z
Created by admin on Fri Dec 15 17:58:57 GMT 2023 , Edited by admin on Fri Dec 15 17:58:57 GMT 2023
PRIMARY
ECHA (EC/EINECS)
210-606-9
Created by admin on Fri Dec 15 17:58:57 GMT 2023 , Edited by admin on Fri Dec 15 17:58:57 GMT 2023
PRIMARY
PUBCHEM
12087
Created by admin on Fri Dec 15 17:58:57 GMT 2023 , Edited by admin on Fri Dec 15 17:58:57 GMT 2023
PRIMARY
EPA CompTox
DTXSID9041659
Created by admin on Fri Dec 15 17:58:57 GMT 2023 , Edited by admin on Fri Dec 15 17:58:57 GMT 2023
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