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Basic Information
CAS No.: 39652-34-1
Name: 3,5-Dichloro-4-methylbenzoic acid
Molecular Structure:
Molecular Structure of 39652-34-1 (3,5-Dichloro-4-methylbenzoic acid)
Formula: C8H6 Cl2 O2
Molecular Weight: 205.04
Synonyms: p-Toluicacid, 3,5-dichloro- (6CI); 3,5-Dichloro-4-methylbenzoic acid
Density: 1.442g/cm3
Melting Point: 187-189 °C(Solv: hexane (110-54-3))
Boiling Point: 330.9°Cat760mmHg
Flash Point: 153.9°C
PSA: 37.30000
LogP: 3.00000
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Chemistry

Molecular Structure of 3,5-Dichloro-4-methylbenzoic acid (CAS No.39652-34-1):
 
Molecular Formula: C8H6Cl2O2
Molecular Weight: 205.038
CAS No: 39652-34-1
H bond acceptors: 2
H bond donors: 1
Freely Rotating Bonds: 1
Polar Surface Area: 37.3 Å2
Index of Refraction: 1.587
Molar Refractivity: 47.79 cm3
Molar Volume: 142.1 cm3
Surface Tension: 50.4 dyne/cm
Density: 1.442 g/cm3
Flash Point: 153.9 °C
Enthalpy of Vaporization: 60.54 kJ/mol
Boiling Point: 330.9 °C at 760 mmHg
Vapour Pressure: 6.44E-05 mmHg at 25°C
Systematic Name: 3,5-Dichloro-4-methylbenzoic acid
InChI: InChI=1/C8H6Cl2O2/c1-4-6(9)2-5(8(11)12)3-7(4)10/h2-3H,1H3,(H,11,12)
InChIKey: GBEJAEMDMASLJL-UHFFFAOYAP
Std. InChI: InChI=1S/C8H6Cl2O2/c1-4-6(9)2-5(8(11)12)3-7(4)10/h2-3H,1H3,(H,11,12)
Std. InChIKey: GBEJAEMDMASLJL-UHFFFAOYSA-N

Specification

  3,5-Dichloro-4-methylbenzoic acid (CAS No.39652-34-1), its synonym is Benzoic acid, 3,5-dichloro-4-methyl- .