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

Details

Stereochemistry RACEMIC
Molecular Formula C6H15NO2
Molecular Weight 133.1888
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-ISOPROPYLAMINO-1,2-PROPANEDIOL

SMILES

CC(C)NCC(O)CO

InChI

InChIKey=YKBZGEJJKPNRSI-UHFFFAOYSA-N
InChI=1S/C6H15NO2/c1-5(2)7-3-6(9)4-8/h5-9H,3-4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C6H15NO2
Molecular Weight 133.1888
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 08:29:05 UTC 2023
Edited
by admin
on Sat Dec 16 08:29:05 UTC 2023
Record UNII
308N9VZ214
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-ISOPROPYLAMINO-1,2-PROPANEDIOL
Systematic Name English
METOPROLOL SUCCINATE IMPURITY N [EP IMPURITY]
Common Name English
(±)-3-ISOPROPYLAMINO-1,2-PROPANEDIOL
Systematic Name English
1,2-DIHYDROXY-3-ISOPROPYLAMINOPROPANE
Systematic Name English
METOPROLOL TARTRATE IMPURITY N [EP IMPURITY]
Common Name English
1,2-PROPANEDIOL, 3-((1-METHYLETHYL)AMINO)-
Systematic Name English
Code System Code Type Description
PUBCHEM
110857
Created by admin on Sat Dec 16 08:29:05 UTC 2023 , Edited by admin on Sat Dec 16 08:29:05 UTC 2023
PRIMARY
FDA UNII
308N9VZ214
Created by admin on Sat Dec 16 08:29:05 UTC 2023 , Edited by admin on Sat Dec 16 08:29:05 UTC 2023
PRIMARY
CAS
6452-57-9
Created by admin on Sat Dec 16 08:29:05 UTC 2023 , Edited by admin on Sat Dec 16 08:29:05 UTC 2023
PRIMARY
ECHA (EC/EINECS)
229-255-8
Created by admin on Sat Dec 16 08:29:05 UTC 2023 , Edited by admin on Sat Dec 16 08:29:05 UTC 2023
PRIMARY
EPA CompTox
DTXSID60983148
Created by admin on Sat Dec 16 08:29:05 UTC 2023 , Edited by admin on Sat Dec 16 08:29:05 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
any spot, apart from the principal spot, is not more intense than the spot in the chromatogram obtained with reference solution (a) (0.5 per cent) and at most 1 such spot is more intense than the spot in the chromatogram obtained with reference solution (b) (0.2 per cent)
CHROMATOGRAPHIC PURITY (TLC)
EP
PARENT -> IMPURITY
any impurity: any spot, apart from the principal spot, is not more intense than the spot in the chromatogram obtained with the reference solution (0.2 per cent)
CHROMATOGRAPHIC PURITY (TLC)
USP