ChemSpider 2D Image | Ethyl 4-(4-sec-butylphenyl)-2-{[4-(cyclopentyloxy)benzoyl]amino}-5-methyl-3-thiophenecarboxylate | C30H35NO4S

Ethyl 4-(4-sec-butylphenyl)-2-{[4-(cyclopentyloxy)benzoyl]amino}-5-methyl-3-thiophenecarboxylate

  • Molecular FormulaC30H35NO4S
  • Average mass505.668 Da
  • Monoisotopic mass505.228668 Da
  • ChemSpider ID3744420

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

3-Thiophenecarboxylic acid, 2-[[4-(cyclopentyloxy)benzoyl]amino]-5-methyl-4-[4-(1-methylpropyl)phenyl]-, ethyl ester [ACD/Index Name]
4-(4-sec-Butylphényl)-2-{[4-(cyclopentyloxy)benzoyl]amino}-5-méthyl-3-thiophènecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-(4-sec-butylphenyl)-2-{[4-(cyclopentyloxy)benzoyl]amino}-5-methyl-3-thiophenecarboxylate [ACD/IUPAC Name]
Ethyl 4-(4-sec-butylphenyl)-2-{[4-(cyclopentyloxy)benzoyl]amino}-5-methylthiophene-3-carboxylate
ethyl 4-[4-(butan-2-yl)phenyl]-2-{[4-(cyclopentyloxy)benzoyl]amino}-5-methylthiophene-3-carboxylate
Ethyl-4-(4-sec-butylphenyl)-2-{[4-(cyclopentyloxy)benzoyl]amino}-5-methyl-3-thiophencarboxylat [German] [ACD/IUPAC Name]
4-(4-sec-Butyl-phenyl)-2-(4-cyclopentyloxy-benzoylamino)-5-methyl-thiophene-3-carboxylic acid ethyl ester
438213-38-8 [RN]
ethyl 2-[(4-cyclopentyloxyphenyl)carbonylamino]-5-methyl-4-[4-(methylpropyl)phenyl]thiophene-3-carboxylate
ETHYL 2-[4-(CYCLOPENTYLOXY)BENZAMIDO]-5-METHYL-4-[4-(SEC-BUTYL)PHENYL]THIOPHENE-3-CARBOXYLATE
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

AK-968/41018191 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 570.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.6±3.0 kJ/mol
Flash Point: 298.9±30.1 °C
Index of Refraction: 1.601
Molar Refractivity: 147.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 9.96
ACD/LogD (pH 5.5): 7.99
ACD/BCF (pH 5.5): 701756.81
ACD/KOC (pH 5.5): 532439.44
ACD/LogD (pH 7.4): 7.99
ACD/BCF (pH 7.4): 701749.88
ACD/KOC (pH 7.4): 532434.13
Polar Surface Area: 93 Å2
Polarizability: 58.3±0.5 10-24cm3
Surface Tension: 47.2±3.0 dyne/cm
Molar Volume: 429.1±3.0 cm3

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