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Details

Stereochemistry RACEMIC
Molecular Formula C13H18ClNO
Molecular Weight 239.741
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of O-BUPROPION

SMILES

CC(NC(C)(C)C)C(=O)C1=CC=CC=C1Cl

InChI

InChIKey=AYTXQMWGRNAJBA-UHFFFAOYSA-N
InChI=1S/C13H18ClNO/c1-9(15-13(2,3)4)12(16)10-7-5-6-8-11(10)14/h5-9,15H,1-4H3

HIDE SMILES / InChI

Molecular Formula C13H18ClNO
Molecular Weight 239.741
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 11:25:15 UTC 2023
Edited
by admin
on Sat Dec 16 11:25:15 UTC 2023
Record UNII
0KQ3BNZ6CS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
O-BUPROPION
Common Name English
1-PROPANONE, 1-(2-CHLOROPHENYL)-2-((1,1-DIMETHYLETHYL)AMINO)-
Systematic Name English
O-BUPROPION [USP IMPURITY]
Common Name English
2-(TERT-BUTYLAMINO)-2-CHLOROPROPIOPHENONE
Systematic Name English
2-(TERT-BUTYLAMINO)-1-(2-CHLOROPHENYL)PROPAN-1-ONE
Systematic Name English
Code System Code Type Description
PUBCHEM
3031064
Created by admin on Sat Dec 16 11:25:15 UTC 2023 , Edited by admin on Sat Dec 16 11:25:15 UTC 2023
PRIMARY
FDA UNII
0KQ3BNZ6CS
Created by admin on Sat Dec 16 11:25:15 UTC 2023 , Edited by admin on Sat Dec 16 11:25:15 UTC 2023
PRIMARY
CAS
1049974-40-4
Created by admin on Sat Dec 16 11:25:15 UTC 2023 , Edited by admin on Sat Dec 16 11:25:15 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP