ChemSpider 2D Image | N-{2-[(4-Methoxybenzyl)(2-pyrimidinyl)amino]ethyl}-N,N-dimethyl-1-hexadecanaminium | C32H55N4O

N-{2-[(4-Methoxybenzyl)(2-pyrimidinyl)amino]ethyl}-N,N-dimethyl-1-hexadecanaminium

  • Molecular FormulaC32H55N4O
  • Average mass511.805 Da
  • Monoisotopic mass511.437042 Da
  • ChemSpider ID5257

  • Charge - Charge

More details:

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

1-Hexadecanaminium, N-[2-[[(4-methoxyphenyl)methyl]-2-pyrimidinylamino]ethyl]-N,N-dimethyl- [ACD/Index Name]
N-{2-[(4-Methoxybenzyl)(2-pyrimidinyl)amino]ethyl}-N,N-dimethyl-1-hexadecanaminium [ACD/IUPAC Name]
N-{2-[(4-Methoxybenzyl)(2-pyrimidinyl)amino]ethyl}-N,N-dimethyl-1-hexadecanaminium [German] [ACD/IUPAC Name]
N-{2-[(4-Méthoxybenzyl)(2-pyrimidinyl)amino]éthyl}-N,N-diméthyl-1-hexadécanaminium [French] [ACD/IUPAC Name]
25466-36-8 [RN]
BPBio1_000914
BSPBio_000830
cetyl-[2-[(4-methoxybenzyl)-pyrimidin-2-yl-amino]ethyl]-dimethyl-ammonium
hexadecyl-[2-[(4-methoxyphenyl)methyl-(2-pyrimidinyl)amino]ethyl]-dimethylammonium
hexadecyl-[2-[(4-methoxyphenyl)methyl-pyrimidin-2-yl-amino]ethyl]-dimethyl-ammonium
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

NCGC00016507-01 [DBID]
NSC5648 [DBID]
Prestwick0_000925 [DBID]
Prestwick1_000925 [DBID]
SPBio_003009 [DBID]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 22
#Rule of 5 Violations: 1
ACD/LogP: 4.75
ACD/LogD (pH 5.5): 4.53
ACD/BCF (pH 5.5): 1641.23
ACD/KOC (pH 5.5): 6964.07
ACD/LogD (pH 7.4): 4.53
ACD/BCF (pH 7.4): 1643.26
ACD/KOC (pH 7.4): 6972.66
Polar Surface Area: 38 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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