ChemSpider 2D Image | 5-(2-AMINOETHYL)-4,7-DIMETHOXYINDANE | C13H19NO2

5-(2-AMINOETHYL)-4,7-DIMETHOXYINDANE

  • Molecular FormulaC13H19NO2
  • Average mass221.296 Da
  • Monoisotopic mass221.141586 Da
  • ChemSpider ID23206516

More details:

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

1H-Indene-5-ethanamine, 2,3-dihydro-4,7-dimethoxy- [ACD/Index Name]
2-(4,7-Dimethoxy-2,3-dihydro-1H-inden-5-yl)ethanamin [German] [ACD/IUPAC Name]
2-(4,7-Dimethoxy-2,3-dihydro-1H-inden-5-yl)ethanamine [ACD/IUPAC Name]
2-(4,7-Diméthoxy-2,3-dihydro-1H-indén-5-yl)éthanamine [French] [ACD/IUPAC Name]
207740-19-0 [RN]
5-(2-AMINOETHYL)-4,7-DIMETHOXYINDANE
2-(4,7-dimethoxy-2,3-dihydro-1H-inden-5-yl)ethan-1-amine
2-(4,7-Dimethoxy-indan-5-yl)-ethylamine
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL341036/
MFCD32691642

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

9UT94P2UB5 [DBID]
UNII:9UT94P2UB5 [DBID]
UNII-9UT94P2UB5 [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 381.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.0±3.0 kJ/mol
Flash Point: 203.1±35.2 °C
Index of Refraction: 1.552
Molar Refractivity: 64.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.46
ACD/LogD (pH 5.5): -0.32
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.55
Polar Surface Area: 44 Å2
Polarizability: 25.7±0.5 10-24cm3
Surface Tension: 40.6±3.0 dyne/cm
Molar Volume: 203.0±3.0 cm3

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