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Details

Stereochemistry ACHIRAL
Molecular Formula C11H7NO
Molecular Weight 169.1794
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 1-NAPHTHYLISOCYANATE

SMILES

O=C=NC1=CC=CC2=CC=CC=C12

InChI

InChIKey=BDQNKCYCTYYMAA-UHFFFAOYSA-N
InChI=1S/C11H7NO/c13-8-12-11-7-3-5-9-4-1-2-6-10(9)11/h1-7H

HIDE SMILES / InChI

Molecular Formula C11H7NO
Molecular Weight 169.1794
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Chiral separation of the β2-sympathomimetic fenoterol by HPLC and capillary zone electrophoresis for pharmacokinetic studies.
2010-10
Measurement of plasma free choline by high performance liquid chromatography with fluorescence detection following derivatization with 1-naphthyl isocyanate.
2009-06-30
Role of neutrophils in the pathogenesis of acute inflammatory liver injury.
2007-10
Biodegradation of poly(propylene glycol)s under the conditions of the OECD screening test.
2007-03
Ketoprofen glucuronidation and bile excretion in carbon tetrachloride and alpha-naphthylisothiocyanate induced hepatic injury rats.
2007-02-12
Protective effect of glycyrrhizin, glycyrrhetic acid and matrine on acute cholestasis induced by alpha-naphthyl isothiocyanate in rats.
2007-02
Utilization of a one-dimensional score for surveying chemical-induced changes in expression levels of multiple biomarker gene sets using a large-scale toxicogenomics database.
2006-12
Comparison of biodegradation of poly(ethylene glycol)s and poly(propylene glycol)s.
2006-07
Use of proteomic methods to identify serum biomarkers associated with rat liver toxicity or hypertrophy.
2005-10
Chemometric analysis of biofluids following toxicant induced hepatotoxicity: a metabonomic approach to distinguish the effects of 1-naphthylisothiocyanate from its products.
2005-08
Comparison of murine cirrhosis models induced by hepatotoxin administration and common bile duct ligation.
2005-07-21
Isolation of poly(propylene glycol)s from water for quantitative analysis by reversed-phase liquid chromatography.
2003-12-22
Hepatoprotection by the farnesoid X receptor agonist GW4064 in rat models of intra- and extrahepatic cholestasis.
2003-12
Determination of alpha-naphthylisothiocyanate and metabolites alpha-naphthylamine and alpha-naphthylisocyanate in rat plasma and urine by high-performance liquid chromatography.
2003-05-05
[Determination of cyclovirobuxine D by RP-HPLC with precolumn fluorescence derivatization].
2002-05
Enantioselective high-performance liquid chromatography of therapeutically relevant aminoalcohols as their fluorescent 1-naphthyl isocyanate derivatives.
2001-05
Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 18:53:26 GMT 2025
Edited
by admin
on Mon Mar 31 18:53:26 GMT 2025
Record UNII
5LH2P0691E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-NAPHTHYLISOCYANATE
MI  
Systematic Name English
NSC-4023
Preferred Name English
ISOCYANIC ACID 1-NAPHTHYL ESTER
Systematic Name English
1-NAPHTHYLISOCYANATE [MI]
Common Name English
.ALPHA.-NAPHTHYL ISOCYANATE
Systematic Name English
NAPHTHYL ISOCYANATE, 1-
Systematic Name English
1-ISOCYANATONAPHTHALENE
Systematic Name English
Code System Code Type Description
MESH
C061621
Created by admin on Mon Mar 31 18:53:26 GMT 2025 , Edited by admin on Mon Mar 31 18:53:26 GMT 2025
PRIMARY
ECHA (EC/EINECS)
201-703-7
Created by admin on Mon Mar 31 18:53:26 GMT 2025 , Edited by admin on Mon Mar 31 18:53:26 GMT 2025
PRIMARY
FDA UNII
5LH2P0691E
Created by admin on Mon Mar 31 18:53:26 GMT 2025 , Edited by admin on Mon Mar 31 18:53:26 GMT 2025
PRIMARY
EPA CompTox
DTXSID9058949
Created by admin on Mon Mar 31 18:53:26 GMT 2025 , Edited by admin on Mon Mar 31 18:53:26 GMT 2025
PRIMARY
CAS
86-84-0
Created by admin on Mon Mar 31 18:53:26 GMT 2025 , Edited by admin on Mon Mar 31 18:53:26 GMT 2025
PRIMARY
NSC
4023
Created by admin on Mon Mar 31 18:53:26 GMT 2025 , Edited by admin on Mon Mar 31 18:53:26 GMT 2025
PRIMARY
MERCK INDEX
m7762
Created by admin on Mon Mar 31 18:53:26 GMT 2025 , Edited by admin on Mon Mar 31 18:53:26 GMT 2025
PRIMARY Merck Index
PUBCHEM
66589
Created by admin on Mon Mar 31 18:53:26 GMT 2025 , Edited by admin on Mon Mar 31 18:53:26 GMT 2025
PRIMARY