U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C13H23BN2O3
Molecular Weight 266.144
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(1-Ethoxyethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole

SMILES

CCOC(C)N1C=C(C=N1)B2OC(C)(C)C(C)(C)O2

InChI

InChIKey=IZKVGEWCELXYRI-UHFFFAOYSA-N
InChI=1S/C13H23BN2O3/c1-7-17-10(2)16-9-11(8-15-16)14-18-12(3,4)13(5,6)19-14/h8-10H,7H2,1-6H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
1-(1-Ethoxyethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole
Preferred Name English
1-(1-Ethoxyethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
Systematic Name English
1-(1-Ethoxyethyl)-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
Systematic Name English
1H-Pyrazole, 1-(1-ethoxyethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
Systematic Name English
Code System Code Type Description
PUBCHEM
46736798
Created by admin on Wed Apr 02 20:21:15 GMT 2025 , Edited by admin on Wed Apr 02 20:21:15 GMT 2025
PRIMARY
CAS
1029716-44-6
Created by admin on Wed Apr 02 20:21:15 GMT 2025 , Edited by admin on Wed Apr 02 20:21:15 GMT 2025
PRIMARY
FDA UNII
B3622LE5H9
Created by admin on Wed Apr 02 20:21:15 GMT 2025 , Edited by admin on Wed Apr 02 20:21:15 GMT 2025
PRIMARY
NIH
NCATS
PRIVACY NOTICE
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966