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Details

Stereochemistry ACHIRAL
Molecular Formula C8H7BrO2
Molecular Weight 215.044
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL 4-BROMOBENZOATE

SMILES

COC(=O)C1=CC=C(Br)C=C1

InChI

InChIKey=CZNGTXVOZOWWKM-UHFFFAOYSA-N
InChI=1S/C8H7BrO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H3

HIDE SMILES / InChI

Molecular Formula C8H7BrO2
Molecular Weight 215.044
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

PubMed

Substance Class Chemical
Record UNII
UB1YSJ5XAR
Record Status Validated (UNII)
Record Version