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Details

Stereochemistry ACHIRAL
Molecular Formula C13H16BClO3
Molecular Weight 266.528
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzoyl chloride

SMILES

CC1(C)OB(OC1(C)C)C2=CC=C(C=C2)C(Cl)=O

InChI

InChIKey=WOCXUWRCQSFHNJ-UHFFFAOYSA-N
InChI=1S/C13H16BClO3/c1-12(2)13(3,4)18-14(17-12)10-7-5-9(6-8-10)11(15)16/h5-8H,1-4H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
4-Chlorocarbonylphenylboronic acid pinacol ester
Preferred Name English
4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzoyl chloride
Systematic Name English
Benzoyl chloride, 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
Systematic Name English
Code System Code Type Description
FDA UNII
FTL5V5J8F4
Created by admin on Wed Apr 02 20:51:52 GMT 2025 , Edited by admin on Wed Apr 02 20:51:52 GMT 2025
PRIMARY
PUBCHEM
57981666
Created by admin on Wed Apr 02 20:51:52 GMT 2025 , Edited by admin on Wed Apr 02 20:51:52 GMT 2025
PRIMARY
CAS
380499-68-3
Created by admin on Wed Apr 02 20:51:52 GMT 2025 , Edited by admin on Wed Apr 02 20:51:52 GMT 2025
PRIMARY
NIH
NCATS
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