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Details

Stereochemistry ACHIRAL
Molecular Formula C14H21NO3
Molecular Weight 251.3214
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-N,N-BIS(2-HYDROXYETHYL)AMINOBUTYROPHENONE

SMILES

CCCC(=O)C1=CC=C(C=C1)N(CCO)CCO

InChI

InChIKey=UTBJDLRJDZIZIF-UHFFFAOYSA-N
InChI=1S/C14H21NO3/c1-2-3-14(18)12-4-6-13(7-5-12)15(8-10-16)9-11-17/h4-7,16-17H,2-3,8-11H2,1H3

HIDE SMILES / InChI

Molecular Formula C14H21NO3
Molecular Weight 251.3214
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 Mon Mar 31 21:30:14 GMT 2025
Edited
by admin
on Mon Mar 31 21:30:14 GMT 2025
Record UNII
PC1D3BYH3B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(4-(BIS(2-HYDROXYETHYL)AMINO)PHENYL)-1-BUTANONE
Preferred Name English
4-N,N-BIS(2-HYDROXYETHYL)AMINOBUTYROPHENONE
Common Name English
4'-(BIS(2-HYDROXYETHYL)AMINO)BUTYROPHENONE
Systematic Name English
1-BUTANONE, 1-(4-(BIS(2-HYDROXYETHYL)AMINO)PHENYL)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID50275448
Created by admin on Mon Mar 31 21:30:14 GMT 2025 , Edited by admin on Mon Mar 31 21:30:14 GMT 2025
PRIMARY
CAS
59486-24-7
Created by admin on Mon Mar 31 21:30:14 GMT 2025 , Edited by admin on Mon Mar 31 21:30:14 GMT 2025
PRIMARY
FDA UNII
PC1D3BYH3B
Created by admin on Mon Mar 31 21:30:14 GMT 2025 , Edited by admin on Mon Mar 31 21:30:14 GMT 2025
PRIMARY
PUBCHEM
43033
Created by admin on Mon Mar 31 21:30:14 GMT 2025 , Edited by admin on Mon Mar 31 21:30:14 GMT 2025
PRIMARY
Related Record Type Details
ACTIVE MOIETY