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O-Methyl-1-acetylbenzocyclobutene oxime

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Name

O-Methyl-1-acetylbenzocyclobutene oxime

EINECS N/A
CAS No. 6813-91-8 Density 1.08g/cm3
PSA 21.59000 LogP 2.34860
Solubility N/A Melting Point N/A
Formula C11H13NO Boiling Point 267.2°Cat760mmHg
Molecular Weight 175.25 Flash Point 95.9°C
Transport Information N/A Appearance N/A
Safety Moderately toxic by intraperitoneal route. A flammable liquid. When heated to decomposition it emits toxic vapors of NOx. Risk Codes N/A
Molecular Structure Molecular Structure of 6813-91-8 (Bicyclo[4.2.0]octa-1,3,5-trien-7-yl(methyl) ketone O-methyl oxime) Hazard Symbols N/A
Synonyms

O-Methyl-1-acetylbenzocyclobutene oxime;O-Methyl-1-acetylbenzoylcyclobutene Oxime;

 

O-Methyl-1-acetylbenzocyclobutene oxime Chemical Properties

IUPAC Name: 1-(8-Bicyclo[4.2.0]octa-1,3,5-trienyl)-N-methoxyethanimine
Synonyms of O-Methyl-1-acetylbenzocyclobutene oxime (CAS NO.6813-91-8): Bicyclo(4.2.0)octa-1,3,5-trien-7-yl methyl ketone O-methyloxime ; Ketone, bicyclo(4.2.0)octa-1,3,5-trien-7-yl methyl, O-methyloxime
CAS NO: 6813-91-8
Molecular Formula: C11H13NO
Molecular Weight: 175.227
Molecular Structure :
H bond acceptors: 2
H bond donors: 0
Freely Rotating Bonds: 2
Polar Surface Area: 21.59 Å2
Index of Refraction: 1.558
Molar Refractivity: 52.212 cm3
Molar Volume: 162.033 cm3
Surface Tension: 34.731 dyne/cm
Density: 1.081 g/cm3
Flash Point: 95.907 °C
Enthalpy of Vaporization: 48.488 kJ/mol
Boiling Point: 267.225 °C at 760 mmHg
Vapour Pressure: 0.014 mmHg at 25°C

O-Methyl-1-acetylbenzocyclobutene oxime Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 550mg/kg (550mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

BEHAVIORAL: ANTIPSYCHOTIC
Journal of Medicinal Chemistry. Vol. 9, Pg. 656, 1966.

O-Methyl-1-acetylbenzocyclobutene oxime Safety Profile

Moderately toxic by intraperitoneal route. A flammable liquid. When O-Methyl-1-acetylbenzocyclobutene oxime (CAS NO.6813-91-8) is heated to decomposition, it emits toxic vapors of NOx.

O-Methyl-1-acetylbenzocyclobutene oxime Standards and Recommendations

DOT Classification:  3; Label: Flammable Liquid

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