1-[3-(DIMETHYLAMINO)PROPYL]-1-(4-FLUOROPHENYL)-1,3-DIHYDRO-5-ISOBENZOFURANCARBOXAMIDE , 0.95 , 64372-56-1

Synonym(s):
1-[3-(Dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-5-isobenzofurancarboxamide

CAS NO.：64372-56-1

Empirical Formula: C20H23FN2O2

Molecular Weight: 342.41

MDL number: MFCD24857372

Update time: 2023-04-23

PRODUCT Properties

Melting point:	126-128℃ (ethanol )
Boiling point:	444.5±45.0 °C(Predicted)
Density	1.183±0.06 g/cm3(Predicted)
storage temp.	-20°C Freezer
solubility	Chloroform (Slightly), Methanol (Slightly)
pka	16.06±0.40(Predicted)
color	White to Off-White
Major Application	pharmaceutical
InChI	1S/C20H23FN2O2/c1-23(2)11-3-10-20(16-5-7-17(21)8-6-16)18-9-4-14(19(22)24)12-15(18)13-25-20/h4-9,12H,3,10-11,13H2,1-2H3,(H2,22,24)
InChIKey	LYYWQJNKWCANAC-UHFFFAOYSA-N
SMILES	Fc1ccc(cc1)C2(OCc3c2ccc(c3)C(=O)N)CCCN(C)C

Description and Uses

1-[3-(Dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-5-isobenzofurancarboxamide (Escitalopram EP Impurity A), is an impurity of Citalopram (C505000), which is an inhibitor of serotonin (5-HT) uptake. It is used as an antidepressant.

Safety

Symbol(GHS)	GHS07,GHS08
Signal word	Warning
Hazard statements	H302-H336-H361d-H412
Precautionary statements	P202-P261-P264-P273-P301+P312-P308+P313
target organs	Central nervous system
WGK Germany	WGK 3
HS Code	2932996560
Storage Class	11 - Combustible Solids
Hazard Classifications	Acute Tox. 4 Oral Aquatic Chronic 3 Repr. 2 STOT SE 3