Molecular Structure of 1-(4-Methylphenyl)-1-cyclopropanecarboxylic acid (CAS No.83846-66-6):
Molecular Formula: C11H12O2
Molecular Weight: 176.2118
CAS No: 83846-66-6
H bond acceptors: 2
H bond donors: 1
Freely Rotating Bonds: 2
Polar Surface Area: 26.3 Å2
Index of Refraction: 1.595
Molar Refractivity: 49.11 cm3
Molar Volume: 144.3 cm3
Surface Tension: 53.8 dyne/cm
Density: 1.22 g/cm3
Flash Point: 150 °C
Enthalpy of Vaporization: 59.97 kJ/mol
Boiling Point: 325.9 °C at 760 mmHg
Vapour Pressure: 9.07E-05 mmHg at 25°C
InChI: InChI=1/C11H12O2/c1-8-2-4-9(5-3-8)11(6-7-11)10(12)13/h2-5H,6-7H2,1H3,(H,12,13)
InChIKey: AYUGAOYMYXSOKU-UHFFFAOYAQ
Std. InChI: InChI=1S/C11H12O2/c1-8-2-4-9(5-3-8)11(6-7-11)10(12)13/h2-5H,6-7H2,1H3,(H,12,13)
Std. InChIKey: AYUGAOYMYXSOKU-UHFFFAOYSA-N
IUPAC Name: 1-(4-Methylphenyl)cyclopropane-1-carboxylic acid
Hazard Codes: Xi
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 24/25
S24/25:Avoid contact with skin and eyes.
1-(4-Methylphenyl)-1-cyclopropanecarboxylic acid (CAS No.83846-66-6), its synonyms are 1-(4-Methylphenyl)cyclopropanecarboxylic acid ; Cyclopropanecarboxylic acid, 1-(4-methylphenyl)- ; 1-(p-Tolyl)cyclopropanecarboxylic acid .
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