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Details

Stereochemistry ACHIRAL
Molecular Formula C7H5ClO
Molecular Weight 140.567
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Chlorocyclohepta-2,4,6-trienone

SMILES

ClC1=CC=CC=CC1=O

InChI

InChIKey=MTHNMAUDCHXFMM-UHFFFAOYSA-N
InChI=1S/C7H5ClO/c8-6-4-2-1-3-5-7(6)9/h1-5H

HIDE SMILES / InChI

Molecular Formula C7H5ClO
Molecular Weight 140.567
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 20:01:41 GMT 2025
Edited
by admin
on Tue Apr 01 20:01:41 GMT 2025
Record UNII
7Y65UFZ23T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Chlorocyclohepta-2,4,6-trienone
Systematic Name English
NSC-328816
Preferred Name English
2,4,6-CYCLOHEPTATRIEN-1-ONE, 2-CHLORO-
Systematic Name English
2-Chloro-2,4,6-cycloheptatrien-1-one
Systematic Name English
2-Chlorocycloheptatrienone
Systematic Name English
2-Chlorotropone
Common Name English
Code System Code Type Description
CAS
3839-48-3
Created by admin on Tue Apr 01 20:01:41 GMT 2025 , Edited by admin on Tue Apr 01 20:01:41 GMT 2025
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PUBCHEM
19691
Created by admin on Tue Apr 01 20:01:41 GMT 2025 , Edited by admin on Tue Apr 01 20:01:41 GMT 2025
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EPA CompTox
DTXSID90191734
Created by admin on Tue Apr 01 20:01:41 GMT 2025 , Edited by admin on Tue Apr 01 20:01:41 GMT 2025
PRIMARY
FDA UNII
7Y65UFZ23T
Created by admin on Tue Apr 01 20:01:41 GMT 2025 , Edited by admin on Tue Apr 01 20:01:41 GMT 2025
PRIMARY
NSC
328816
Created by admin on Tue Apr 01 20:01:41 GMT 2025 , Edited by admin on Tue Apr 01 20:01:41 GMT 2025
PRIMARY