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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 (3-(Ethoxycarbonyl)phenyl)boronic acid

SMILES

CCOC(=O)C1=CC=CC(=C1)B(O)O

InChI

InChIKey=REHVCPNQQBDOJJ-UHFFFAOYSA-N
InChI=1S/C9H11BO4/c1-2-14-9(11)7-4-3-5-8(6-7)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 Sat Dec 16 16:14:26 GMT 2023
Edited
by admin
on Sat Dec 16 16:14:26 GMT 2023
Record UNII
63752S6NBJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(3-(Ethoxycarbonyl)phenyl)boronic acid
Systematic Name English
m-Carbethoxyphenylboronic acid
Systematic Name English
Benzoic acid, m-borono-, ethyl ester
Systematic Name English
Benzoic acid, 3-borono-, 1-ethyl ester
Systematic Name English
Ethyl 3-boronobenzoate
Systematic Name English
Benzoic acid, m-borono-, 1-ethyl ester
Systematic Name English
Code System Code Type Description
PUBCHEM
3249312
Created by admin on Sat Dec 16 16:14:26 GMT 2023 , Edited by admin on Sat Dec 16 16:14:26 GMT 2023
PRIMARY
CAS
4334-87-6
Created by admin on Sat Dec 16 16:14:26 GMT 2023 , Edited by admin on Sat Dec 16 16:14:26 GMT 2023
PRIMARY
EPA CompTox
DTXSID20390632
Created by admin on Sat Dec 16 16:14:26 GMT 2023 , Edited by admin on Sat Dec 16 16:14:26 GMT 2023
PRIMARY
FDA UNII
63752S6NBJ
Created by admin on Sat Dec 16 16:14:26 GMT 2023 , Edited by admin on Sat Dec 16 16:14:26 GMT 2023
PRIMARY