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5352-90-9

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Basic Information
CAS No.: 5352-90-9
Name: Perphenazine maleate
Molecular Structure:
Molecular Structure of 5352-90-9 (Perphenazine maleate)
Formula: C21H26ClN3OS•C4H4O4
Molecular Weight: 520.09
Synonyms: Perphenazine dimaleate;UNII-7K96LZ09JI;Perphenazine maleate [JAN];1-Piperazineethanol,4-(3-(2-chlorophenothiazin-10-yl)propyl)-,maleate;Perphenazine maleate (JP16);(Z)-but-2-enedioic acid,2-[4-[3-(2-chlorophenothiazin-10-yl)propyl]piperazin-1-yl]ethanol;Perphenazine maleate;
Boiling Point: 580.4°C at 760 mmHg
Flash Point: 304.8°C
Safety: Poison by ingestion and intraperitoneal routes. When heated to decomposition it emits toxic fumes of Cl−, NOx, and SOx.
PSA: 204.45000
LogP: 3.30710
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Chemistry

Product Name: Perphenazine maleate
CAS Registry Number: 5352-90-9 
Synonyms: Perphenazine maleate ; 1-Piperazineethanol, 4-(3-(2-chlorophenothiazin-10-yl)propyl)-, maleate 
IUPAC Name: (Z)-but-2-enedioic acid ; 2-[4-[3-(2-chlorophenothiazin-10-yl)propyl]piperazin-1-yl]ethanol
Empirical Formula: C25H30ClN3O5S
Molecular Weight: 520.0408
Flash Point: 304.8 °C
Enthalpy of Vaporization: 91.32 kJ/mol
Boiling Point: 580.4 °C at 760 mmHg
Vapour Pressure: 2.6E-14 mmHg at 25°C
Following is the molecular structure of Perphenazine maleate (CAS NO.5352-90-9) is:

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 206mg/kg (206mg/kg)   Drugs in Japan Vol. 6, Pg. 768, 1982.
mouse LD50 oral 392mg/kg (392mg/kg)   Drugs in Japan Vol. 6, Pg. 768, 1982.
rat LD50 intraperitoneal 133mg/kg (133mg/kg)   Drugs in Japan Vol. 6, Pg. 768, 1982.
rat LD50 oral 317mg/kg (317mg/kg)   Drugs in Japan Vol. 6, Pg. 768, 1982.

Safety Profile

Poison by ingestion and intraperitoneal routes. When heated to decomposition it emits toxic fumes of Cl−, NOx, and SOx.

Specification

Descriptors computed from structure, you can know some information about Perphenazine maleate (CAS NO.5352-90-9) is:
Canonical SMILES: C1CN(CCN1CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)CCO.C(=CC(=O)O)C(=O)O.C(=CC(=
O)O)C(=O)O
Isomeric SMILES: C1N(CCN(C1)CCO)CCCN2C3=C(SC4=CC=CC=C24)C=CC(=C3)Cl.C(=C\C(=O)O)\C(=O)O.C
(=C\C(=O)O)\C(=O)O
InChI: InChI=1S/C21H26ClN3OS.2C4H4O4/c22-17-6-7-21-19(16-17)25(18-4-1-2-5-20
(18)27-21)9-3-8-23-10-12-24(13-11-23)14-15-26;2*5-3(6)1-2-4(7)8/h1-2,
4-7,16,26H,3,8-15H2;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-
InChIKey: HYYMPXVEPSKZOU-SPIKMXEPSA-N