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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 4-Chloro-9H-thioxanthen-9-one

SMILES

ClC1=CC=CC2=C1SC3=C(C=CC=C3)C2=O

InChI

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

Substance Class Chemical
Created
by admin
on Tue Apr 01 19:16:28 GMT 2025
Edited
by admin
on Tue Apr 01 19:16:28 GMT 2025
Record UNII
77XL4WZR6S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-Chloro-9H-thioxanthen-9-one
Systematic Name English
4-chlorothioxanthen-9-one
Preferred Name English
9H-Thioxanthen-9-one, 4-chloro-
Systematic Name English
Code System Code Type Description
CAS
21908-85-0
Created by admin on Tue Apr 01 19:16:28 GMT 2025 , Edited by admin on Tue Apr 01 19:16:28 GMT 2025
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FDA UNII
77XL4WZR6S
Created by admin on Tue Apr 01 19:16:28 GMT 2025 , Edited by admin on Tue Apr 01 19:16:28 GMT 2025
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PUBCHEM
89102
Created by admin on Tue Apr 01 19:16:28 GMT 2025 , Edited by admin on Tue Apr 01 19:16:28 GMT 2025
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EPA CompTox
DTXSID50176325
Created by admin on Tue Apr 01 19:16:28 GMT 2025 , Edited by admin on Tue Apr 01 19:16:28 GMT 2025
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ECHA (EC/EINECS)
244-655-2
Created by admin on Tue Apr 01 19:16:28 GMT 2025 , Edited by admin on Tue Apr 01 19:16:28 GMT 2025
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