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Details

Stereochemistry RACEMIC
Molecular Formula C19H21ClFNO
Molecular Weight 333.828
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(4-FLUOROPHENYL)-1-(3-DIMETHYLAMINOPROPYL)-5-CHLOROPHTHALANE

SMILES

CN(C)CCCC1(OCC2=C1C=CC(Cl)=C2)C3=CC=C(F)C=C3

InChI

InChIKey=COAPWBUTTSOWLG-UHFFFAOYSA-N
InChI=1S/C19H21ClFNO/c1-22(2)11-3-10-19(15-4-7-17(21)8-5-15)18-9-6-16(20)12-14(18)13-23-19/h4-9,12H,3,10-11,13H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C19H21ClFNO
Molecular Weight 333.828
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 Fri Dec 15 17:36:57 UTC 2023
Edited
by admin
on Fri Dec 15 17:36:57 UTC 2023
Record UNII
69X04IVZ4W
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(4-FLUOROPHENYL)-1-(3-DIMETHYLAMINOPROPYL)-5-CHLOROPHTHALANE
Common Name English
LU 10-134C
Code English
1-ISOBENZOFURANPROPANAMINE, 5-CHLORO-1-(4-FLUOROPHENYL)-1,3-DIHYDRO-N,N-DIMETHYL-
Systematic Name English
CITALOPRAM RELATED COMPOUND G [USP IMPURITY]
Common Name English
CITALOPRAM HYDROCHLORIDE IMPURITY E [EP IMPURITY]
Common Name English
CITALOPRAM HYDROBROMIDE IMPURITY E [EP IMPURITY]
Common Name English
3-((1RS)-5-CHLORO-1-(4-FLUOROPHENYL)-1,3-DIHYDROISOBENZOFURAN-1-YL)-N,N-DIMETHYLPROPAN-1-AMINE
Systematic Name English
CITALOPRAM RELATED COMPOUND G [USP-RS]
Common Name English
(±)-1-(4-FLUOROPHENYL)-1-(3-DIMETHYLAMINOPROPYL)-5-CHLOROPHTHALANE
Common Name English
Code System Code Type Description
FDA UNII
69X04IVZ4W
Created by admin on Fri Dec 15 17:36:57 UTC 2023 , Edited by admin on Fri Dec 15 17:36:57 UTC 2023
PRIMARY
CAS
64169-45-5
Created by admin on Fri Dec 15 17:36:57 UTC 2023 , Edited by admin on Fri Dec 15 17:36:57 UTC 2023
PRIMARY
RS_ITEM_NUM
1134197
Created by admin on Fri Dec 15 17:36:57 UTC 2023 , Edited by admin on Fri Dec 15 17:36:57 UTC 2023
PRIMARY
PUBCHEM
10088219
Created by admin on Fri Dec 15 17:36:57 UTC 2023 , Edited by admin on Fri Dec 15 17:36:57 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP