Found 535 results

Search term: MF = 'C_{12}H_{9}ClO_{2}S'
ChemSpider 2D Image | 2-Chloro-4-(4-methyl-2-thienyl)benzoic acid | C12H9ClO2S

2-Chloro-4-(4-methyl-2-thienyl)benzoic acid

  • Molecular FormulaC12H9ClO2S
  • Average mass252.717 Da
  • Monoisotopic mass252.001175 Da
  • ChemSpider ID26544928

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2-Chlor-4-(4-methyl-2-thienyl)benzoesäure [German] [ACD/IUPAC Name]
2-Chloro-4-(4-methyl-2-thienyl)benzoic acid [ACD/IUPAC Name]
Acide 2-chloro-4-(4-méthyl-2-thiényl)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 2-chloro-4-(4-methyl-2-thienyl)- [ACD/Index Name]
1261900-69-9 [RN]
2-Chloro-4-(4-methylthiophen-2-yl)benzoic acid
2-CHLORO-4-(4-METHYLTHIOPHENYL)BENZOIC ACID

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 392.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.7±3.0 kJ/mol
Flash Point: 190.9±27.9 °C
Index of Refraction: 1.631
Molar Refractivity: 65.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.13
ACD/LogD (pH 5.5): 1.88
ACD/BCF (pH 5.5): 4.16
ACD/KOC (pH 5.5): 19.73
ACD/LogD (pH 7.4): 1.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.94
Polar Surface Area: 66 Å2
Polarizability: 26.1±0.5 10-24cm3
Surface Tension: 53.2±3.0 dyne/cm
Molar Volume: 185.0±3.0 cm3

Click to predict properties on the Chemicalize site


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