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Details

Stereochemistry ACHIRAL
Molecular Formula C8H12O
Molecular Weight 124.1803
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of 3,5-OCTADIEN-2-ONE, (3E,5E)-

SMILES

C\C=C\C\C=C\C(C)=O

InChI

InChIKey=GUUFTBQLGJOXEM-FZWLCVONSA-N
InChI=1S/C8H12O/c1-3-4-5-6-7-8(2)9/h3-4,6-7H,5H2,1-2H3/b4-3+,7-6+

HIDE SMILES / InChI

Molecular Formula C8H12O
Molecular Weight 124.1803
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 2
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 18:32:12 GMT 2023
Edited
by admin
on Fri Dec 15 18:32:12 GMT 2023
Record UNII
TD4E94AD7V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,5-OCTADIEN-2-ONE, (3E,5E)-
Systematic Name English
3,5-OCTADIEN-2-ONE, (E,E)-
Systematic Name English
(E,E)-3,5-OCTADIEN-2-ONE
FHFI  
Systematic Name English
(E,E)-3,5-OCTADIEN-2-ONE [FHFI]
Common Name English
(3E,5E)-OCTADIEN-2-ONE
Systematic Name English
FEMA NO. 4008
Code English
(3E,5E)-3,5-OCTADIEN-2-ONE
Systematic Name English
Classification Tree Code System Code
JECFA EVALUATION (E,E)-3,5-OCTADIEN-2-ONE
Created by admin on Fri Dec 15 18:32:12 GMT 2023 , Edited by admin on Fri Dec 15 18:32:12 GMT 2023
Code System Code Type Description
CAS
30086-02-3
Created by admin on Fri Dec 15 18:32:12 GMT 2023 , Edited by admin on Fri Dec 15 18:32:12 GMT 2023
PRIMARY
EPA CompTox
DTXSID701016433
Created by admin on Fri Dec 15 18:32:12 GMT 2023 , Edited by admin on Fri Dec 15 18:32:12 GMT 2023
PRIMARY
PUBCHEM
6434070
Created by admin on Fri Dec 15 18:32:12 GMT 2023 , Edited by admin on Fri Dec 15 18:32:12 GMT 2023
PRIMARY
JECFA MONOGRAPH
1071
Created by admin on Fri Dec 15 18:32:12 GMT 2023 , Edited by admin on Fri Dec 15 18:32:12 GMT 2023
PRIMARY
FDA UNII
TD4E94AD7V
Created by admin on Fri Dec 15 18:32:12 GMT 2023 , Edited by admin on Fri Dec 15 18:32:12 GMT 2023
PRIMARY