U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS
This repository is under review for potential modification in compliance with Administration directives.

Details

Stereochemistry ACHIRAL
Molecular Formula C8H19NO2
Molecular Weight 161.242
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-BUTYLDIETHANOLAMINE

SMILES

CCCCN(CCO)CCO

InChI

InChIKey=GVNHOISKXMSMPX-UHFFFAOYSA-N
InChI=1S/C8H19NO2/c1-2-3-4-9(5-7-10)6-8-11/h10-11H,2-8H2,1H3

HIDE SMILES / InChI

Molecular Formula C8H19NO2
Molecular Weight 161.242
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
H963NLD48W
Record Status Validated (UNII)
Record Version