ChemSpider 2D Image | 1-[(2,2-Dimethyl-3,4-dihydro-2H-chromen-6-yl)acetyl]-4-piperidinecarboxylic acid | C19H25NO4

1-[(2,2-Dimethyl-3,4-dihydro-2H-chromen-6-yl)acetyl]-4-piperidinecarboxylic acid

  • Molecular FormulaC19H25NO4
  • Average mass331.406 Da
  • Monoisotopic mass331.178345 Da
  • ChemSpider ID30719991

More details:






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

1-[(2,2-Dimethyl-3,4-dihydro-2H-chromen-6-yl)acetyl]-4-piperidincarbonsäure [German] [ACD/IUPAC Name]
1-[(2,2-Dimethyl-3,4-dihydro-2H-chromen-6-yl)acetyl]-4-piperidinecarboxylic acid [ACD/IUPAC Name]
4-Piperidinecarboxylic acid, 1-[2-(3,4-dihydro-2,2-dimethyl-2H-1-benzopyran-6-yl)acetyl]- [ACD/Index Name]
Acide 1-[2-(2,2-diméthyl-3,4-dihydro-2H-chromén-6-yl)acétyl]-4-pipéridinecarboxylique [French] [ACD/IUPAC Name]
1-(2-(2,2-dimethylchroman-6-yl)acetyl)piperidine-4-carboxylic acid
1-[(2,2-dimethyl-3,4-dihydro-2H-chromen-6-yl)acetyl]piperidine-4-carboxylic acid
1-[2-(2,2-dimethyl-3,4-dihydrochromen-6-yl)acetyl]piperidine-4-carboxylic acid
1574301-96-4 [RN]
C19H25NO4

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

Density: 1.2±0.1 g/cm3
Boiling Point: 546.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 86.9±3.0 kJ/mol
Flash Point: 284.4±30.1 °C
Index of Refraction: 1.557
Molar Refractivity: 89.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.14
ACD/LogD (pH 5.5): 2.11
ACD/BCF (pH 5.5): 13.22
ACD/KOC (pH 5.5): 112.09
ACD/LogD (pH 7.4): 0.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.77
Polar Surface Area: 67 Å2
Polarizability: 35.5±0.5 10-24cm3
Surface Tension: 47.6±3.0 dyne/cm
Molar Volume: 278.0±3.0 cm3

Click to predict properties on the Chemicalize site






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