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Details

Stereochemistry ACHIRAL
Molecular Formula C13H7ClOS
Molecular Weight 246.712
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-CHLOROTHIOXANTHONE

SMILES

ClC1=CC2=C(SC3=C(C=CC=C3)C2=O)C=C1

InChI

InChIKey=ZCDADJXRUCOCJE-UHFFFAOYSA-N
InChI=1S/C13H7ClOS/c14-8-5-6-12-10(7-8)13(15)9-3-1-2-4-11(9)16-12/h1-7H

HIDE SMILES / InChI

Molecular Formula C13H7ClOS
Molecular Weight 246.712
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Photophysics and photochemistry of z-chlorprothixene in acetonitrile.
2009-08-27
Patents

Patents

Substance Class Chemical
Created
by admin
on Mon Mar 31 18:12:05 GMT 2025
Edited
by admin
on Mon Mar 31 18:12:05 GMT 2025
Record UNII
RGS87T004B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-CHLOROTHIOXANTHONE
Systematic Name English
9H-THIOXANTHEN-9-ONE, 2-CHLORO-
Preferred Name English
CHLORPROTHIXENE HYDROCHLORIDE IMPURITY E [EP IMPURITY]
Common Name English
2-chloro-9H-thioxanthen-9-one
Common Name English
Code System Code Type Description
FDA UNII
RGS87T004B
Created by admin on Mon Mar 31 18:12:05 GMT 2025 , Edited by admin on Mon Mar 31 18:12:05 GMT 2025
PRIMARY
CAS
86-39-5
Created by admin on Mon Mar 31 18:12:05 GMT 2025 , Edited by admin on Mon Mar 31 18:12:05 GMT 2025
PRIMARY
EPA CompTox
DTXSID90861667
Created by admin on Mon Mar 31 18:12:05 GMT 2025 , Edited by admin on Mon Mar 31 18:12:05 GMT 2025
PRIMARY
ECHA (EC/EINECS)
201-667-2
Created by admin on Mon Mar 31 18:12:05 GMT 2025 , Edited by admin on Mon Mar 31 18:12:05 GMT 2025
PRIMARY
PUBCHEM
618848
Created by admin on Mon Mar 31 18:12:05 GMT 2025 , Edited by admin on Mon Mar 31 18:12:05 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> IMPURITY