PHENYLISOCYANATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H5NO
Molecular Weight	119.1207
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O=C=NC1=CC=CC=C1

InChI

InChIKey=DGTNSSLYPYDJGL-UHFFFAOYSA-N

InChI=1S/C7H5NO/c9-6-8-7-4-2-1-3-5-7/h1-5H

HIDE SMILES / InChI

Molecular Formula	C7H5NO
Molecular Weight	119.1207
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
Determination of aliphatic alcohols after on-line microwave-assisted derivatization by liquid chromatography-photodiode array detection.	2004 Dec 15	18969749
3,3'-Diphenyl-1,1'-[2,2'-oxybis(2,1-phenyl-ene)]diurea N,N-dimethyl-formamide disolvate.	2007 Dec 18	21200869
UV-induced photochemistry of matrix-isolated 1-phenyl-4-allyl-tetrazolone.	2007 Nov	17973049
Induction of apoptosis by phenylisocyanate derivative of quercetin: involvement of heat shock protein.	2007 Nov	17893517
Catalysis over zinc-incorporated berlinite (ZnAlPO4) of the methoxycarbonylation of 1,6-hexanediamine with dimethyl carbonate to form dimethylhexane-1,6-dicarbamate.	2007 Nov 7	17988376
Hsf1 activation inhibits rapamycin resistance and TOR signaling in yeast revealed by combined proteomic and genetic analysis.	2008 Feb 13	18270585
Rapid characterization of fatty alcohol ethoxylates by non-aqueous capillary electrophoresis.	2008 Jul	18576365
Photochemistry of 5-allyloxy-tetrazoles: steady-state and laser flash photolysis study.	2008 Mar 21	18327330
Oxygen-atom transfer from carbon dioxide to a Fischer carbene at (PNP)Ir.	2008 May 7	18410098
Validation of transferability of DBA derivatization and LC-MS/MS determination method for isocyanates via an interlaboratory comparison.	2008 Nov	18812390
Aniline in hydrolyzed urine and plasma--possible biomarkers for phenylisocyanate exposure.	2008 Oct	18666023
In vitro biologic activities of the antimicrobials triclocarban, its analogs, and triclosan in bioassay screens: receptor-based bioassay screens.	2008 Sep	18795164
Immobilization of (1S,2R)-(+)-2-amino-1,2-diphenylethanol derivates on aminated silica gel with different linkages as chiral stationary phases and their enantioseparation evaluation by HPLC.	2009 Apr	18655165
2-Methyl-1,2,3,4-tetra-hydro-isoquinolin-6-yl N-phenyl-carbamate.	2009 Apr 18	21583875
Ethyl 5-methyl-4-oxo-3-phenyl-2-propyl-amino-3,4-dihydro-thieno[2,3-d]pyrimidine-6-carboxyl-ate.	2009 Aug 29	21577661
Synthesis of new imidazolidin-2,4-dione and 2-thioxoimidazolidin-4-ones via C-phenylglycine derivatives.	2009 Dec 30	20110877
Copper(II) Nanoballs as monomers for polyurethane coatings: synthesis, urethane derivatization and kinetic stability.	2009 Feb 28	19462657
Synthesis and antiproliferative activity of 3-amino-N-phenyl-1H-indazole-1-carboxamides.	2009 Jan	18485541
Suicide nucleophilic attack: reactions of benzohydroxamate anion with bis(2,4-dinitrophenyl) phosphate.	2009 Jul 17	19459594
Synthesis and structures of titanium and yttrium complexes with N,N'-tetramethylguanidinate ligands: different reactivity of the M-N bonds toward phenyl isocyanate.	2009 Mar 14	19240915
Quantitative analysis of valiolamine through pre-column derivatization with phenylisocyanate using high-performance liquid chromatography with UV detection: selection of reagent, identification of derivative and optimization of derivatization conditions.	2009 May 1	19303235
Analysis of aminoglycoside residues in bovine milk by liquid chromatography electrospray ion trap mass spectrometry after derivatization with phenyl isocyanate.	2009 May 15	19345161
Recent advances in synthetic bioelastomers.	2009 Nov 20	20057942
Cholest-5-en-3β-yl N-phenyl-carbamate.	2009 Nov 28	21578937
3-(2-Amino-ethyl)-2-anilinoquinazolin-4(3H)-one methanol hemisolvate.	2009 Nov 4	21578729
c-3,t-3-Dimethyl-4-oxo-r-2,c-6-diphenyl-piperidine-1-carboxamide.	2009 Oct 23	21578400
Towards defining molecular determinants recognized by adaptive immunity in allergic disease: an inventory of the available data.	2010	21403821
2-Anilino-3-(2-hy-droxy-phen-yl)quinazolin-4(3H)-one methanol monosolvate.	2010 Aug 11	21588596
3-Phenyl-2-(pyrrolidin-1-yl)-5,6-dihydro-8H-thio-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one.	2010 Aug 25	21588734
Cyclo-hexane-1,3-diyl bis-(N-phenyl-carbamate).	2010 Aug 28	21588737
Addition reactions to the intramolecular mesityl2P-CH2-CH2-B(C6F5)2 frustrated Lewis pair.	2010 Aug 28	20617234
Structure and dynamic features of an intramolecular frustrated Lewis pair.	2010 Dec 17	20981668
N-Phenyl-morpholine-4-carboxamide.	2010 Dec 24	21522724
Analytical characterization of PEG polymers by MEKC.	2010 Jan	20094992
Synthesis of new glycosyl biuret and urea derivatives as potential glycoenzyme inhibitors.	2010 Jan 26	20004366
Isocyanate diinsertion into the N-H bond of the 2-pyridylamino ligand of organolanthanides.	2010 Jan 7	20023953
Latent enamine functionality of 5-methyl-2,3-dihydropyrazines.	2010 Jul	20606338
Facile double-lithiation of a transient urea: vicarious ortho-metalation of aniline derivatives.	2010 Jul 2	20527906
2-[2-(2-Anilino-4-oxo-3,4-dihydro-quinazolin-3-yl)phen-oxy]-3-phenyl-quinazolin-4(3H)-one methanol hemisolvate.	2010 Jul 21	21588376
2,10-Bis(3-bromo-phen-yl)-3,7,11,15-tetra-oxa-8,16-diaza-tricyclo-[12.2.1.1]octa-deca-1(16),6(18),8,14(17)-tetra-ene.	2010 Jul 24	21588410
The roots of bioinformatics in protein evolution.	2010 Jul 29	20686682
2-(4-Methyl-cyclo-hex-3-en-yl)propan-2-yl N-phenyl-carbamate.	2010 Jul 3	21588225
Ethyl (2,5-dioxo-1-phenyl-2,3-dihydro-1H,5H-1-benzofuro[3,2-d]imidazo[1,2-a]pyrimidin-3-yl)acetate.	2010 Jul 31	21588454
Synthesis and properties of chiral pyrazolidines derived from (+)-pulegone.	2010 Jul 5	20496356
Preparation and enantioseparation of a mixed selector chiral stationary phase derived from benzoylated tartaric acid and 1,2-diphenylethylenediamine.	2010 Jun	19899156
Synthesis and cyclisation of 1,4-disubstituted semicarbazides.	2010 Mar	20221937
Synthesis, characterization, and in vitro antimicrobial activities of 5-alkenyl/hydroxyalkenyl-2-phenylamine-1,3,4-oxadiazoles and thiadiazoles.	2010 Mar 15	20172722
A new general pathway for synthesis of reference compounds of N-terminal valine-isocyanate adducts.	2010 Mar 15	20085231
2-Anilino-3-(2-hy-droxy-phen-yl)quinazolin-4(3H)-one-triphenyl-phosphine oxide (1/1).	2010 Sep 8	21587516
Diphenylthiourea, a common rubber chemical, is bioactivated to potent skin sensitizers.	2011 Jan 14	21073181

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:22:23 GMT 2023` Edited by `admin` on `Fri Dec 15 15:22:23 GMT 2023`
Record UNII	196GO6BSOH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PHENYLISOCYANATE

Systematic Name

English

PHENYL ISOCYANATE [MI]

Common Name

English

PHENYL ISOCYANATE [HSDB]

Common Name

English

NSC-74454

Code

English

PHENYL ISOCYANATE

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

203-137-6