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Details

Stereochemistry ACHIRAL
Molecular Formula C14H19BrO4
Molecular Weight 331.202
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Ethyl 3-bromo-2,4-dihydroxy-6-pentylbenzoate

SMILES

CCCCCC1=CC(O)=C(Br)C(O)=C1C(=O)OCC

InChI

InChIKey=FZSJCOAUZKPAEK-UHFFFAOYSA-N
InChI=1S/C14H19BrO4/c1-3-5-6-7-9-8-10(16)12(15)13(17)11(9)14(18)19-4-2/h8,16-17H,3-7H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C14H19BrO4
Molecular Weight 331.202
Charge 0
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
E7VEA4JF39
Record Status Validated (UNII)
Record Version