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Substance Name: p-Ethoxybenzaldehyde
RN: 10031-82-0
UNII: GOW1H0F49A
InChIKey: JRHHJNMASOIRDS-UHFFFAOYSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C9-H10-O2

Molecular Weight

  • 150.176
 
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Names and Synonyms

Name of Substance

  • p-Ethoxybenzaldehyde

Synonyms

  • 4-08-00-00254 (Beilstein Handbook Reference)
  • 4-Ethoxybenzaldehyde
  • AI3-05684
  • Benzaldehyde, 4-ethoxy-
  • Benzaldehyde, p-ethoxy-
  • BRN 0386863
  • EINECS 233-093-3
  • Ethoxybenzaldehyde
  • FEMA No. 2413
  • Homoanisaldehyde
  • NSC 406709
  • p-Ethoxybenzaldehyde
  • UNII-GOW1H0F49A

Systematic Names

  • 4-Ethoxybenzaldehyde
  • Benzaldehyde, 4-ethoxy-
  • Benzaldehyde, p-ethoxy-

Superlist Name

  • Ethoxybenzaldehyde, p-

Registry Numbers

CAS Registry Number

  • 10031-82-0

FDA UNII

  • GOW1H0F49A

System Generated Number

  • 0010031820

Structure Descriptors

InChI

1S/C9H10O2/c1-2-11-9-5-3-8(7-10)4-6-9/h3-7H,2H2,1H3

InChIKey

JRHHJNMASOIRDS-UHFFFAOYSA-N

Smiles

CCOc1ccc(cc1)C=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin > 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 18, Pg. 681, 1980.
rat LD50 oral 2100mg/kg (2100mg/kg)   Food and Cosmetics Toxicology. Vol. 18, Pg. 681, 1980.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 13.5 deg C   EXP
Boiling Point 249 deg C   EXP
log P (octanol-water) 2.280 (none)   EST
Atmospheric OH Rate Constant 3.01E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.