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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=C(C=CC=C1)B(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

Approval Year

Unknown
139594
Name Type Language
1-Ethyl 2-boronobenzoate
Systematic Name English
2-Ethoxycarbonylphenylboronic acid
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 Sat Dec 16 19:22:29 GMT 2023 , Edited by admin on Sat Dec 16 19:22:29 GMT 2023
PRIMARY
FDA UNII
B5E3T39L3Q
Created by admin on Sat Dec 16 19:22:29 GMT 2023 , Edited by admin on Sat Dec 16 19:22:29 GMT 2023
PRIMARY
PUBCHEM
2773405
Created by admin on Sat Dec 16 19:22:29 GMT 2023 , Edited by admin on Sat Dec 16 19:22:29 GMT 2023
PRIMARY
CAS
380430-53-5
Created by admin on Sat Dec 16 19:22:29 GMT 2023 , Edited by admin on Sat Dec 16 19:22:29 GMT 2023
PRIMARY
NIH
NCATS
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