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Substance Name: Undecanal
RN: 112-44-7
UNII: B6P0A9PSHN
InChIKey: KMPQYAYAQWNLME-UHFFFAOYSA-N

Classification Codes

  • Natural Product
  • Skin / Eye Irritant

Molecular Formula

  • C11-H22-O

Molecular Weight

  • 170.294
 
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Names and Synonyms

Name of Substance

  • Undecanal

Synonyms

  • 1-Undecanal
  • 4-01-00-03374 (Beilstein Handbook Reference)
  • AI3-05098
  • Aldehyde C-11
  • Aldehyde C-11, undecylic
  • BRN 1753213
  • C-11 aldehyde, undecylic
  • C11 aldehyde
  • EC 203-972-6
  • EINECS 203-972-6
  • FEMA No. 3092
  • Hendecanal
  • Hendecanaldehyde
  • n-Undecanal
  • n-Undecyl aldehyde
  • NSC 22578
  • Undecanal
  • Undecanal (natural)
  • Undecanaldehyde
  • Undecanone, alpha-
  • Undecyl aldehyde
  • Undecylaldehyde
  • Undecylic aldehyde
  • UNII-B6P0A9PSHN

Systematic Names

  • 1-Undecanal
  • Undecanal

Superlist Name

  • Undecanal

Registry Numbers

CAS Registry Number

  • 112-44-7

FDA UNII

  • B6P0A9PSHN

System Generated Number

  • 0000112447

Structure Descriptors

InChI

1S/C11H22O/c1-2-3-4-5-6-7-8-9-10-11-12/h11H,2-10H2,1H3

InChIKey

KMPQYAYAQWNLME-UHFFFAOYSA-N

Smiles

C(CCCCC=O)CCCCC

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -4.00E+00 deg C   EXP
log P (octanol-water) 4.250 (none)   EST
Atmospheric OH Rate Constant 3.59E-11 cm3/molecule-sec 25 EST

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