ChemSpider 2D Image | 16-[(Carboxymethyl)(propionyl)amino]hexadecanoic acid | C21H39NO5

16-[(Carboxymethyl)(propionyl)amino]hexadecanoic acid

  • Molecular FormulaC21H39NO5
  • Average mass385.538 Da
  • Monoisotopic mass385.282837 Da
  • ChemSpider ID28586691

More details:

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

16-[(Carboxymethyl)(propionyl)amino]hexadecanoic acid [ACD/IUPAC Name]
16-[(Carboxymethyl)(propionyl)amino]hexadecansäure [German] [ACD/IUPAC Name]
Acide 16-[(carboxyméthyl)(propionyl)amino]hexadécanoïque [French] [ACD/IUPAC Name]
Hexadecanoic acid, 16-[(carboxymethyl)(1-oxopropyl)amino]- [ACD/Index Name]
16-[(Carboxymethyl)(propanoyl)amino]hexadecanoic acid
16-[N-(CARBOXYMETHYL)PROPANAMIDO]HEXADECANOIC ACID
920982-64-5 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 566.8±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 93.0±6.0 kJ/mol
Flash Point: 296.6±23.2 °C
Index of Refraction: 1.488
Molar Refractivity: 106.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 1
ACD/LogP: 5.41
ACD/LogD (pH 5.5): 1.62
ACD/BCF (pH 5.5): 1.94
ACD/KOC (pH 5.5): 7.90
ACD/LogD (pH 7.4): -0.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 95 Å2
Polarizability: 42.1±0.5 10-24cm3
Surface Tension: 42.6±3.0 dyne/cm
Molar Volume: 368.8±3.0 cm3

Click to predict properties on the Chemicalize site


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