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Details

Stereochemistry ACHIRAL
Molecular Formula C8H14O2
Molecular Weight 142.1956
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,3-DIMETHYL-2,5-HEXANEDIONE

SMILES

CC(=O)CC(C)(C)C(C)=O

InChI

InChIKey=CRVBWHZZWOZRCY-UHFFFAOYSA-N
InChI=1S/C8H14O2/c1-6(9)5-8(3,4)7(2)10/h5H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C8H14O2
Molecular Weight 142.1956
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 Fri Dec 15 19:44:24 GMT 2023
Edited
by admin
on Fri Dec 15 19:44:24 GMT 2023
Record UNII
POJ60J6753
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,3-DIMETHYL-2,5-HEXANEDIONE
Systematic Name English
2,5-HEXANEDIONE, 3,3-DIMETHYL-
Systematic Name English
Code System Code Type Description
CAS
866-71-7
Created by admin on Fri Dec 15 19:44:24 GMT 2023 , Edited by admin on Fri Dec 15 19:44:24 GMT 2023
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EPA CompTox
DTXSID80235691
Created by admin on Fri Dec 15 19:44:24 GMT 2023 , Edited by admin on Fri Dec 15 19:44:24 GMT 2023
PRIMARY
PUBCHEM
164742
Created by admin on Fri Dec 15 19:44:24 GMT 2023 , Edited by admin on Fri Dec 15 19:44:24 GMT 2023
PRIMARY
FDA UNII
POJ60J6753
Created by admin on Fri Dec 15 19:44:24 GMT 2023 , Edited by admin on Fri Dec 15 19:44:24 GMT 2023
PRIMARY