ChemSpider 2D Image | 2-Ethoxybenzaldehyde | C9H10O2

2-Ethoxybenzaldehyde

  • Molecular FormulaC9H10O2
  • Average mass150.174 Da
  • Monoisotopic mass150.068085 Da
  • ChemSpider ID21171512

More details:

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

210-349-2 [EINECS]
2-Ethoxybenzaldehyd [German] [ACD/IUPAC Name]
2-Ethoxybenzaldehyde [ACD/IUPAC Name]
2-Éthoxybenzaldéhyde [French] [ACD/IUPAC Name]
613-69-4 [RN]
Benzaldehyde, 2-ethoxy- [ACD/Index Name]
[613-69-4] [RN]
10031-82-0 [RN]
210-349-2MFCD00003316
233-093-3 [EINECS]
More...

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

MFCD00003316 [DBID]
153729_ALDRICH [DBID]
CCRIS 4693 [DBID]
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Safety:

      26-37 Alfa Aesar A15035
      36/37/38 Alfa Aesar A15035
      H315-H319-H335 Alfa Aesar A15035
      P261-P280-P305+P351+P338-P304+P340-P405-P501a Alfa Aesar A15035
      Warning Alfa Aesar A15035
      WARNING: Irritates lungs, eyes, skin Alfa Aesar A15035
  • Gas Chromatography

    • Retention Index (Kovats):

      1271 (estimated with error: 89) NIST Spectra mainlib_133381, replib_231981
      1283 (Program type: Isothermal; Col... (show more) umn class: Standard non-polar; Column length: 5 m; Column type: Packed; Start T: 140 C; CAS no: 613694; Active phase: OV-101; Carrier gas: N2; Substrate: Chromosorb G HP; Data type: Kovats RI; Authors: Righezza, M.; Hassani, A.; Meklati, B.Y.; Chretien, J.R., Quantitative structure-retention relationships (QSRR) of congeneric aromatics series studied on phenyl OV phases in gas chromatography, J. Chromatogr. A, 723, 1996, 77-91.) NIST Spectra nist ri
      1286.4 (Program type: Isothermal; Col... (show more) umn class: Standard non-polar; Column length: 5 m; Column type: Packed; Start T: 160 C; CAS no: 613694; Active phase: OV-101; Carrier gas: N2; Substrate: Chromosorb G HP; Data type: Kovats RI; Authors: Hassani, A.; Meklati, B.Y., Gas chromatographic behaviour of monosubstituted benzenes, benzaldehydes and acetophenones on OV polymethylphenyl-silicone stationary phases, Chromatographia, 33(5/6), 1992, 267-271.) NIST Spectra nist ri

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

Density: 1.1±0.1 g/cm3
Boiling Point: 247.9±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.5±3.0 kJ/mol
Flash Point: 91.7±0.0 °C
Index of Refraction: 1.538
Molar Refractivity: 44.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.25
ACD/LogD (pH 5.5): 1.98
ACD/BCF (pH 5.5): 18.94
ACD/KOC (pH 5.5): 285.75
ACD/LogD (pH 7.4): 1.98
ACD/BCF (pH 7.4): 18.94
ACD/KOC (pH 7.4): 285.75
Polar Surface Area: 26 Å2
Polarizability: 17.6±0.5 10-24cm3
Surface Tension: 36.8±3.0 dyne/cm
Molar Volume: 141.6±3.0 cm3

Click to predict properties on the Chemicalize site


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