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Details

Stereochemistry ACHIRAL
Molecular Formula C13H17Cl2NO
Molecular Weight 274.186
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-CHLOROBUPROPION

SMILES

CC(NC(C)(C)C)C(=O)C1=CC(Cl)=CC(Cl)=C1

InChI

InChIKey=ZKFFJBXJJFDBJM-UHFFFAOYSA-N
InChI=1S/C13H17Cl2NO/c1-8(16-13(2,3)4)12(17)9-5-10(14)7-11(15)6-9/h5-8,16H,1-4H3

HIDE SMILES / InChI

Molecular Formula C13H17Cl2NO
Molecular Weight 274.186
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:40:52 UTC 2023
Edited
by admin
on Sat Dec 16 18:40:52 UTC 2023
Record UNII
MZ54X0ANF3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-CHLOROBUPROPION
Common Name English
1-PROPANONE, 1-(3,5-DICHLOROPHENYL)-2-((1,1-DIMETHYLETHYL)AMINO)-
Systematic Name English
5-CHLOROBUPROPION [USP IMPURITY]
Common Name English
2-(TERT-BUTYLAMINO)-3,5-DICHLOROPROPIOPHENONE.
Systematic Name English
2-(TERT-BUTYLAMINO)-1-(3,5-DICHLOROPHENYL)PROPAN-1-ONE
Systematic Name English
1-(3,5-DICHLOROPHENYL)-2-((1,1-DIMETHYLETHYL)AMINO)-1-PROPANONE
Systematic Name English
Code System Code Type Description
CAS
1193779-48-4
Created by admin on Sat Dec 16 18:40:52 UTC 2023 , Edited by admin on Sat Dec 16 18:40:52 UTC 2023
PRIMARY
FDA UNII
MZ54X0ANF3
Created by admin on Sat Dec 16 18:40:52 UTC 2023 , Edited by admin on Sat Dec 16 18:40:52 UTC 2023
PRIMARY
PUBCHEM
44542511
Created by admin on Sat Dec 16 18:40:52 UTC 2023 , Edited by admin on Sat Dec 16 18:40:52 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP