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Details

Stereochemistry ACHIRAL
Molecular Formula C9H11BO4
Molecular Weight 193.992
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-Ethyl 2-boronobenzoate

SMILES

CCOC(=O)C1=CC=CC=C1B(O)O

InChI

InChIKey=QZKVVOXAEBCLPZ-UHFFFAOYSA-N
InChI=1S/C9H11BO4/c1-2-14-9(11)7-5-3-4-6-8(7)10(12)13/h3-6,12-13H,2H2,1H3

HIDE SMILES / InChI

Molecular Formula C9H11BO4
Molecular Weight 193.992
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 Wed Apr 02 15:25:55 GMT 2025
Edited
by admin
on Wed Apr 02 15:25:55 GMT 2025
Record UNII
B5E3T39L3Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Ethoxycarbonylphenylboronic acid
Preferred Name English
1-Ethyl 2-boronobenzoate
Systematic Name English
Benzoic acid, 2-borono-, 1-ethyl ester
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID70378440
Created by admin on Wed Apr 02 15:25:55 GMT 2025 , Edited by admin on Wed Apr 02 15:25:55 GMT 2025
PRIMARY
FDA UNII
B5E3T39L3Q
Created by admin on Wed Apr 02 15:25:55 GMT 2025 , Edited by admin on Wed Apr 02 15:25:55 GMT 2025
PRIMARY
PUBCHEM
2773405
Created by admin on Wed Apr 02 15:25:55 GMT 2025 , Edited by admin on Wed Apr 02 15:25:55 GMT 2025
PRIMARY
CAS
380430-53-5
Created by admin on Wed Apr 02 15:25:55 GMT 2025 , Edited by admin on Wed Apr 02 15:25:55 GMT 2025
PRIMARY