ChemSpider 2D Image | N-Methyl-1-{4-[(4-methyl-1,4-diazepan-1-yl)methyl]phenyl}methanamine | C15H25N3

N-Methyl-1-{4-[(4-methyl-1,4-diazepan-1-yl)methyl]phenyl}methanamine

  • Molecular FormulaC15H25N3
  • Average mass247.379 Da
  • Monoisotopic mass247.204849 Da
  • ChemSpider ID21474461

More details:

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

Benzenemethanamine, 4-[(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)methyl]-N-methyl- [ACD/Index Name]
N-Methyl-1-{4-[(4-methyl-1,4-diazepan-1-yl)methyl]phenyl}methanamin [German] [ACD/IUPAC Name]
N-Methyl-1-{4-[(4-methyl-1,4-diazepan-1-yl)methyl]phenyl}methanamine [ACD/IUPAC Name]
N-Méthyl-1-{4-[(4-méthyl-1,4-diazépan-1-yl)méthyl]phényl}méthanamine [French] [ACD/IUPAC Name]
884507-55-5 [RN]
Benzenemethanamine,4-[(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)methyl]-N-methyl-
methyl({4-[(4-methyl(1,4-diazaperhydroepinyl))methyl]phenyl}methyl)amine
METHYL({4-[(4-METHYL-1,4-DIAZEPAN-1-YL)METHYL]PHENYL}METHYL)AMINE
MFCD09817487 [MDL number]
N-Methyl-1-(4-((4-methyl-1,4-diazepan-1-yl)methyl)phenyl)methanamine
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 342.9±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 58.7±3.0 kJ/mol
Flash Point: 159.7±21.2 °C
Index of Refraction: 1.540
Molar Refractivity: 77.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.97
ACD/LogD (pH 5.5): -2.68
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.36
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 19 Å2
Polarizability: 30.6±0.5 10-24cm3
Surface Tension: 38.6±3.0 dyne/cm
Molar Volume: 246.2±3.0 cm3

Click to predict properties on the Chemicalize site


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