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Details

Stereochemistry ACHIRAL
Molecular Formula C11H7NS
Molecular Weight 185.245
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 2-NAPHTHYLISOTHIOCYANATE

SMILES

S=C=NC1=CC2=C(C=CC=C2)C=C1

InChI

InChIKey=RTMXPNYHPHIDHX-UHFFFAOYSA-N
InChI=1S/C11H7NS/c13-8-12-11-6-5-9-3-1-2-4-10(9)7-11/h1-7H

HIDE SMILES / InChI

Molecular Formula C11H7NS
Molecular Weight 185.245
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Cholestatic potentials of alpha-naphthylisothiocyanate (ANIT) and beta-naphthylisothiocyanate (BNIT) in the isolated perfused rat liver.
1993 Dec 3
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 18:38:05 GMT 2023
Edited
by admin
on Fri Dec 15 18:38:05 GMT 2023
Record UNII
N2LP7A9XG2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-NAPHTHYLISOTHIOCYANATE
Systematic Name English
.BETA.-NAPHTHYL ISOTHIOCYANATE
Systematic Name English
2-ISOTHIOCYANATONAPHTHALENE
Systematic Name English
NSC-93938
Code English
2-NAPHTHYL ISOTHIOCYANATE
Systematic Name English
NAPHTHALEN-2-YL ISOTHIOCYANATE
Systematic Name English
NAPHTHALENE, 2-ISOTHIOCYANATO-
Systematic Name English
ISOTHIOCYANIC ACID, 2-NAPHTHYL ESTER
Common Name English
Code System Code Type Description
FDA UNII
N2LP7A9XG2
Created by admin on Fri Dec 15 18:38:05 GMT 2023 , Edited by admin on Fri Dec 15 18:38:05 GMT 2023
PRIMARY
NSC
93938
Created by admin on Fri Dec 15 18:38:05 GMT 2023 , Edited by admin on Fri Dec 15 18:38:05 GMT 2023
PRIMARY
PUBCHEM
74222
Created by admin on Fri Dec 15 18:38:05 GMT 2023 , Edited by admin on Fri Dec 15 18:38:05 GMT 2023
PRIMARY
EPA CompTox
DTXSID30876634
Created by admin on Fri Dec 15 18:38:05 GMT 2023 , Edited by admin on Fri Dec 15 18:38:05 GMT 2023
PRIMARY
CAS
1636-33-5
Created by admin on Fri Dec 15 18:38:05 GMT 2023 , Edited by admin on Fri Dec 15 18:38:05 GMT 2023
PRIMARY
MESH
C031287
Created by admin on Fri Dec 15 18:38:05 GMT 2023 , Edited by admin on Fri Dec 15 18:38:05 GMT 2023
PRIMARY