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53734-79-5

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Basic Information
CAS No.: 53734-79-5
Name: Incazane
Molecular Structure:
Molecular Structure of 53734-79-5 (Incazane)
Formula: C15H17 N3 O . Cl H
Molecular Weight: 291.78
Synonyms: 1H-3,4,6a-Triazafluoranthene,2,4,5,6-tetrahydro-9-methoxy-4-methyl-, monohydrochloride (9CI);3-Methyl-8-methoxy-3H-1,2,5,6-tetrahydropyrazino[1,2,3-a,b]-b-carboline hydrochloride;Incazan; Incazane; Inkasan; Metralindole hydrochloride
Density: 1.33g/cm3
Melting Point: 305-308°
Boiling Point: 461.2°Cat760mmHg
Flash Point: 232.7°C
Safety: Poison by subcutaneous and intravenous routes. Moderately toxic by ingestion. When heated to decomposition it emits toxic fumes of NOx and HCl.
PSA: 29.76000
LogP: 2.07350
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Chemistry

Product Name: Incasan (CAS NO.53734-79-5)


Molecular Formula: C15H17N3O•ClH
Molecular Weight: 291.81g/mol
Mol File: 53734-79-5.mol
Boiling point: 461.2 °C at 760 mmHg
Flash Point: 232.7 °C
Water Solubility: 1.09E-08 mmHg at 25°C
Enthalpy of Vaporization: 72.2 kJ/mol
H-Bond Donor: 1
H-Bond Acceptor: 3
Structure Descriptors of Incasan (CAS NO.53734-79-5):
  Canonical SMILES: CN1CCN2C3=C(C=C(C=C3)OC)C4=C2C1=NCC4.Cl
  InChI: InChI=1S/C15H17N3O.ClH/c1-17-7-8-18-13-4-3-10(19-2)9-12(13)11-5-6-16-15(17)14(11)18;/h3-4,9H,5-8H2,1-2H3;1H 
  InChIKey: RQQVSZWEVNAKGW-UHFFFAOYSA-N

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 200mg/kg (200mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

CARDIAC: OTHER CHANGES

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES		 Pharmaceutical Chemistry Journal Vol. 22, Pg. 181, 1988.
mouse LD50 intravenous 85mg/kg (85mg/kg) BEHAVIORAL: EUPHORIA Farmakologiya i Toksikologiya Vol. 43, Pg. 133, 1980.
mouse LD50 oral 445mg/kg (445mg/kg) BEHAVIORAL: EUPHORIA Farmakologiya i Toksikologiya Vol. 43, Pg. 133, 1980.
mouse LD50 subcutaneous 250mg/kg (250mg/kg) BEHAVIORAL: EUPHORIA Farmakologiya i Toksikologiya Vol. 43, Pg. 133, 1980.
rabbit LDLo oral 250mg/kg (250mg/kg)   Pharmaceutical Chemistry Journal Vol. 22, Pg. 181, 1988.
rat LD50 oral 1400mg/kg (1400mg/kg) BEHAVIORAL: TREMOR

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD		 Pharmaceutical Chemistry Journal Vol. 22, Pg. 181, 1988.

Safety Profile

Poison by subcutaneous and intravenous routes. Moderately toxic by ingestion. When heated to decomposition it emits toxic fumes of NOx and HCl.

Specification

 Incasan ,its CAS NO. is 53734-79-5,the synonyms is  Metralindole hydrochloride ; 3-Methyl-8-methoxy-3H,1,2,5,6-tetrahydropyrazino-(1,2,3-ab)-beta-carboline hydrochloride ; Incazane ; Inkasan ; Metralindole HCl ; 1H-3,4,6a-Triazafluoranthene, 2,4,5,6-tetrahydro-9-methoxy-4-methyl-, monohydrochloride .