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Details

Stereochemistry ACHIRAL
Molecular Formula 3C6H7O2.Al
Molecular Weight 360.3373
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 6
Charge 0

SHOW SMILES / InChI
Structure of ALUMINUM SORBATE

SMILES

[Al+3].C\C=C\C=C\C([O-])=O.C\C=C\C=C\C([O-])=O.C\C=C\C=C\C([O-])=O

InChI

InChIKey=UUGHYISAEYRDII-KWYLWIMLSA-K
InChI=1S/3C6H8O2.Al/c3*1-2-3-4-5-6(7)8;/h3*2-5H,1H3,(H,7,8);/q;;;+3/p-3/b3*3-2+,5-4+;

HIDE SMILES / InChI

Molecular Formula C6H7O2
Molecular Weight 111.1186
Charge -1
Count
MOL RATIO 3 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 2
Optical Activity NONE

Molecular Formula Al
Molecular Weight 26.9815386
Charge 3
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
T7RHV9IMCS
Record Status Validated (UNII)
Record Version