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Details

Stereochemistry ACHIRAL
Molecular Formula C14H9NOS
Molecular Weight 239.292
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Benzophenone-4-isothiocyanate

SMILES

O=C(C1=CC=CC=C1)C2=CC=C(C=C2)N=C=S

InChI

InChIKey=FMSYGGOEIOBUOR-UHFFFAOYSA-N
InChI=1S/C14H9NOS/c16-14(11-4-2-1-3-5-11)12-6-8-13(9-7-12)15-10-17/h1-9H

HIDE SMILES / InChI

Molecular Formula C14H9NOS
Molecular Weight 239.292
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 Sat Dec 16 15:41:35 GMT 2023
Edited
by admin
on Sat Dec 16 15:41:35 GMT 2023
Record UNII
822NDN9MZT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Benzophenone-4-isothiocyanate
Systematic Name English
4-Benzoylphenyl isothiocyanate
Systematic Name English
4-Isothiocyanatobenzophenone
Systematic Name English
Benzophenone, 4-hydroxy-, isothiocyanate
Systematic Name English
(4-Isothiocyanatophenyl)phenylmethanone
Systematic Name English
Methanone, (4-isothiocyanatophenyl)phenyl-
Systematic Name English
Code System Code Type Description
PUBCHEM
11436384
Created by admin on Sat Dec 16 15:41:35 GMT 2023 , Edited by admin on Sat Dec 16 15:41:35 GMT 2023
PRIMARY
CAS
26328-59-6
Created by admin on Sat Dec 16 15:41:35 GMT 2023 , Edited by admin on Sat Dec 16 15:41:35 GMT 2023
PRIMARY
EPA CompTox
DTXSID50465842
Created by admin on Sat Dec 16 15:41:35 GMT 2023 , Edited by admin on Sat Dec 16 15:41:35 GMT 2023
PRIMARY
FDA UNII
822NDN9MZT
Created by admin on Sat Dec 16 15:41:35 GMT 2023 , Edited by admin on Sat Dec 16 15:41:35 GMT 2023
PRIMARY