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Details

Stereochemistry ACHIRAL
Molecular Formula C14H22BNO2
Molecular Weight 247.141
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of [3-tert-Butyl-4-(pyrrolidin-1-yl)phenyl]boronic acid

SMILES

CC(C)(C)C1=CC(=CC=C1N2CCCC2)B(O)O

InChI

InChIKey=QAPKAEMTJUVEKT-UHFFFAOYSA-N
InChI=1S/C14H22BNO2/c1-14(2,3)12-10-11(15(17)18)6-7-13(12)16-8-4-5-9-16/h6-7,10,17-18H,4-5,8-9H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C14H22BNO2
Molecular Weight 247.141
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 15:48:03 GMT 2025
Edited
by admin
on Wed Apr 02 15:48:03 GMT 2025
Record UNII
JM9LAD8DFM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
B-[3-(1,1-Dimethylethyl)-4-(1-pyrrolidinyl)phenyl]boronic acid
Preferred Name English
[3-tert-Butyl-4-(pyrrolidin-1-yl)phenyl]boronic acid
Systematic Name English
[3-tert-Butyl-4-(pyrrolidino)phenyl]boronic acid
Systematic Name English
Boronic acid, B-[3-(1,1-dimethylethyl)-4-(1-pyrrolidinyl)phenyl]-
Systematic Name English
Code System Code Type Description
PUBCHEM
66672251
Created by admin on Wed Apr 02 15:48:03 GMT 2025 , Edited by admin on Wed Apr 02 15:48:03 GMT 2025
PRIMARY
FDA UNII
JM9LAD8DFM
Created by admin on Wed Apr 02 15:48:03 GMT 2025 , Edited by admin on Wed Apr 02 15:48:03 GMT 2025
PRIMARY
CAS
895543-00-7
Created by admin on Wed Apr 02 15:48:03 GMT 2025 , Edited by admin on Wed Apr 02 15:48:03 GMT 2025
PRIMARY