PLANNED MAINTENANCE

There will be scheduled maintenance work beginning on Wednesday 26th February 2020 from 11:00 AM through to 12.00 PM (GMT).

During this time, you may not be able to log into ChemSpider. We apologise for any inconvenience this might cause and thank you for your patience.


ChemSpider 2D Image | 2413 | C9H10O2

2413

  • Molecular FormulaC9H10O2
  • Average mass150.174 Da
  • Monoisotopic mass150.068085 Da
  • ChemSpider ID21105889

More details:






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

10031-82-0 [RN]
233-093-3 [EINECS]
2413
4-Ethoxybenzaldehyd [German] [ACD/IUPAC Name]
4-Ethoxybenzaldehyde [ACD/IUPAC Name]
4-Éthoxybenzaldéhyde [French] [ACD/IUPAC Name]
Benzaldehyde, 4-ethoxy- [ACD/Index Name]
CU6100000
p-ethoxybenzaldehyde
[10031-82-0]
More...

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

GOW1H0F49A [DBID]
MFCD00003388 [DBID]
02567_FLUKA [DBID]
173606_ALDRICH [DBID]
AI3-05684 [DBID]
BRN 0386863 [DBID]
CCRIS 4693 [DBID]
FEMA No. 2413 [DBID]
NSC 406709 [DBID]
NSC406709 [DBID]
More...
  • Experimental Physico-chemical Properties
  • Miscellaneous
    • Appearance:

      Brown liquid Novochemy [NC-29884]
      colourless liquid with a sweet, floral, anise odour Food and Agriculture Organization of the United Nations 4-Ethoxybenzaldehyde
    • Safety:

      20/21/22 Novochemy [NC-29884]
      20/21/36/37/39 Novochemy [NC-29884]
      26-37 Alfa Aesar A11987
      36/38 Alfa Aesar A11987
      GHS02; GHS07; GHS09 Novochemy [NC-29884]
      GHS07 Biosynth W-108968
      H315; H319; H335 Biosynth W-108968
      H315-H319 Alfa Aesar A11987
      H332; H403 Novochemy [NC-29884]
      IRRITANT Matrix Scientific 075572
      Irritant SynQuest 2615-1-26
      Irritant/Air Sensitive/Store under Argon SynQuest 2615-1-26
      P261; P305+P351+P338 Biosynth W-108968
      P280-P305+P351+P338-P362-P321-P332+P313-P337+P313 Alfa Aesar A11987
      P309+P311; P211; P242 Novochemy [NC-29884]
      R52/53 Novochemy [NC-29884]
      Warning Alfa Aesar A11987
      Warning Biosynth W-108968
      Warning Novochemy [NC-29884]
      WARNING: Irritates lungs, eyes, skin Alfa Aesar A11987
  • Gas Chromatography
    • Retention Index (Kovats):

      1271 (estimated with error: 89) NIST Spectra mainlib_227691, replib_135369, replib_4684, replib_285214
      1301.4 (Program type: Isothermal; Col... (show more) umn class: Standard non-polar; Column length: 5 m; Column type: Packed; Start T: 140 C; CAS no: 10031820; 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
      1310.6 (Program type: Isothermal; Col... (show more) umn class: Standard non-polar; Column length: 5 m; Column type: Packed; Start T: 160 C; CAS no: 10031820; 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
      1302.4 (Program type: Isothermal; Col... (show more) umn class: Standard non-polar; Column length: 5 ft; Column type: Packed; Start T: 150 C; CAS no: 10031820; Active phase: OV-101; Carrier gas: N2; Substrate: Chromosorb G HP; Data type: Kovats RI; Authors: Maeck, M.; Touabet, A.; Badjah Hadj Ahmed, A.Y.; Meklati, B.Y., A numerical interpolation of Kovats indices without dead time correction, Chromatographia, 27(5/6), 1989, 205-208.) NIST Spectra nist ri
    • Retention Index (Normal Alkane):

      1308 (Program type: Ramp; Column cl... (show more) ass: Standard non-polar; Column type: Capillary; CAS no: 10031820; Active phase: SE-30; Data type: Normal alkane RI; Authors: Vinogradov, B.A., Production, composition, properties and application of essential oils, 2004.) 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: 249.0±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.6±3.0 kJ/mol
Flash Point: 112.6±13.4 °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: 2.23
ACD/LogD (pH 5.5): 1.98
ACD/BCF (pH 5.5): 18.97
ACD/KOC (pH 5.5): 286.03
ACD/LogD (pH 7.4): 1.98
ACD/BCF (pH 7.4): 18.97
ACD/KOC (pH 7.4): 286.03
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






Advertisement