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Details

Stereochemistry ACHIRAL
Molecular Formula C19H11NS
Molecular Weight 285.362
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 6-CHRYSENYLISOTHIOCYANATE

SMILES

S=C=NC1=C2C=CC=CC2=C3C=CC4=CC=CC=C4C3=C1

InChI

InChIKey=CIAHPHFXCYGAPB-UHFFFAOYSA-N
InChI=1S/C19H11NS/c21-12-20-19-11-18-14-6-2-1-5-13(14)9-10-16(18)15-7-3-4-8-17(15)19/h1-11H

HIDE SMILES / InChI

Molecular Formula C19H11NS
Molecular Weight 285.362
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 18:32:56 GMT 2023
Edited
by admin
on Fri Dec 15 18:32:56 GMT 2023
Record UNII
YHH2L1HH7P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-CHRYSENYLISOTHIOCYANATE
Systematic Name English
6-ISOTHIOCYANATOCHRYSENE
Systematic Name English
CHRYSENE, 6-ISOTHIOCYANATO-
Systematic Name English
ISOTHIOCYANATOCHRYSENE, 6-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID00241310
Created by admin on Fri Dec 15 18:32:56 GMT 2023 , Edited by admin on Fri Dec 15 18:32:56 GMT 2023
PRIMARY
CAS
94255-53-5
Created by admin on Fri Dec 15 18:32:56 GMT 2023 , Edited by admin on Fri Dec 15 18:32:56 GMT 2023
PRIMARY
PUBCHEM
151989
Created by admin on Fri Dec 15 18:32:56 GMT 2023 , Edited by admin on Fri Dec 15 18:32:56 GMT 2023
PRIMARY
FDA UNII
YHH2L1HH7P
Created by admin on Fri Dec 15 18:32:56 GMT 2023 , Edited by admin on Fri Dec 15 18:32:56 GMT 2023
PRIMARY