ChemSpider 2D Image | N18EXB6V6P | C6H11N

N18EXB6V6P

  • Molecular FormulaC6H11N
  • Average mass97.158 Da
  • Monoisotopic mass97.089149 Da
  • ChemSpider ID21106561

More details:



Featured data source



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

(CH2=CHCH2)2NH
124-02-7 [RN]
204-671-2 [EINECS]
2-Propen-1-amine, N-2-propen-1-yl- [ACD/Index Name]
Amine, diallyl-
bis(prop-2-en-1-yl)amine
DI-2-PROPENYLAMINE
Diallylamine
N-(prop-2-en-1-yl)prop-2-en-1-amine
N,N-diallylamine
More...

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

AI3-15324 [DBID]
BRN 0773718 [DBID]
CCRIS 4776 [DBID]
D9603_ALDRICH [DBID]
HSDB 5471 [DBID]
MFCD00060150 [DBID]
NSC 20948 [DBID]
NSC20948 [DBID]
UN2359 [DBID]
  • Experimental Physico-chemical Properties
  • Miscellaneous
    • Safety:

      11-20/22-24-34 Alfa Aesar A18950
      16-23-26-33-36/37/39-45 Alfa Aesar A18950
      3 Alfa Aesar A18950
      Danger Alfa Aesar A18950
      DANGER: FLAMMABLE, CORROSIVE, burns skin and eyes Alfa Aesar A18950
      H225-H311-H330-H314-H302 Alfa Aesar A18950
      P210-P303+P361+P353-P304+P340-P305+P351+P338-P320-P330-P361-P405-P501a Alfa Aesar A18950
  • Gas Chromatography
    • Retention Index (Kovats):

      796 (estimated with error: 83) NIST Spectra mainlib_341322, replib_896, replib_19687, replib_228922
      660 (Program type: Isothermal; Col... (show more) umn class: Standard non-polar; Column length: 1 m; Column type: Packed; Start T: 130 C; CAS no: 124027; Active phase: OV-101; Carrier gas: Ar; Substrate: Chromosorb W HP; Data type: Kovats RI; Authors: Osmialowski, K.; Halkiewicz, J.; Radecki, A.; Kaliszan, R., Quantum chemical parameters in correlation analysis of gas-liquid chromatographic retention indices of amines, J. Chromatogr., 346, 1985, 53-60.) NIST Spectra nist ri
    • Retention Index (Normal Alkane):

      660 (Program type: Isothermal; Col... (show more) umn class: Standard non-polar; Column type: Capillary; Start T: 130 C; CAS no: 124027; Active phase: OV-101; Data type: Normal alkane RI; Authors: Qi, Y.; Yang, J.; Xu, L., correlation analysis of the structures and gas liquid chromatographic retention indices of amines, Chin. J. Anal. Chem., 28(2), 2000, 223-227.) NIST Spectra nist ri

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

Density: 0.8±0.1 g/cm3
Boiling Point: 115.3±9.0 °C at 760 mmHg
Vapour Pressure: 19.2±0.2 mmHg at 25°C
Enthalpy of Vaporization: 35.4±3.0 kJ/mol
Flash Point: 15.6±0.0 °C
Index of Refraction: 1.433
Molar Refractivity: 32.9±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.11
ACD/LogD (pH 5.5): -1.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.01
Polar Surface Area: 12 Å2
Polarizability: 13.0±0.5 10-24cm3
Surface Tension: 22.9±3.0 dyne/cm
Molar Volume: 126.6±3.0 cm3

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