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Details

Stereochemistry ACHIRAL
Molecular Formula C13H11ClO3
Molecular Weight 250.678
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(2-CHLOROPHENYL)CARBONYLCYCLOHEXANE-1,3-DIONE

SMILES

ClC1=CC=CC=C1C(=O)C2C(=O)CCCC2=O

InChI

InChIKey=TYJXBELAFWQDPT-UHFFFAOYSA-N
InChI=1S/C13H11ClO3/c14-9-5-2-1-4-8(9)13(17)12-10(15)6-3-7-11(12)16/h1-2,4-5,12H,3,6-7H2

HIDE SMILES / InChI

Molecular Formula C13H11ClO3
Molecular Weight 250.678
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 Sat Dec 16 16:07:31 GMT 2023
Edited
by admin
on Sat Dec 16 16:07:31 GMT 2023
Record UNII
2W2PNW1O2Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(2-CHLOROPHENYL)CARBONYLCYCLOHEXANE-1,3-DIONE
Systematic Name English
1,3-CYCLOHEXANEDIONE, 2-(2-CHLOROBENZOYL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
14301628
Created by admin on Sat Dec 16 16:07:31 GMT 2023 , Edited by admin on Sat Dec 16 16:07:31 GMT 2023
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FDA UNII
2W2PNW1O2Z
Created by admin on Sat Dec 16 16:07:31 GMT 2023 , Edited by admin on Sat Dec 16 16:07:31 GMT 2023
PRIMARY
EPA CompTox
DTXSID30558701
Created by admin on Sat Dec 16 16:07:31 GMT 2023 , Edited by admin on Sat Dec 16 16:07:31 GMT 2023
PRIMARY
CAS
88562-09-8
Created by admin on Sat Dec 16 16:07:31 GMT 2023 , Edited by admin on Sat Dec 16 16:07:31 GMT 2023
PRIMARY