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Substance Name: Acetic acid, nonyl ester
RN: 143-13-5
UNII: M2SE618B1L
InChIKey: GJQIMXVRFNLMTB-UHFFFAOYSA-N

Molecular Formula

  • C11-H22-O2

Molecular Weight

  • 186.293
 
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Names and Synonyms

Name of Substance

  • Acetic acid, nonyl ester
  • n-Nonyl acetate
  • Nonyl acetate

Synonyms

  • 1-Acetoxynonane
  • 1-Nonyl acetate
  • Acetate C-9
  • Acetic acid n-nonyl ester
  • Acetic acid, nonyl ester
  • AI3-11583
  • EINECS 205-585-8
  • FEMA No. 2788
  • n-Nonanyl acetate
  • n-Nonyl acetate
  • n-Nonyl ethanoate
  • Nonanol acetate
  • Nonyl acetate
  • Nonyl alcohol, acetate (6CI)
  • Nonyl ethanoate
  • NSC 82356
  • Pelargonyl acetate
  • UNII-M2SE618B1L

Systematic Names

  • Acetic acid, nonyl ester
  • Nonyl acetate

Superlist Name

  • Nonyl acetate

Registry Numbers

CAS Registry Number

  • 143-13-5

FDA UNII

  • M2SE618B1L

System Generated Number

  • 0000143135

Structure Descriptors

InChI

1S/C11H22O2/c1-3-4-5-6-7-8-9-10-13-11(2)12/h3-10H2,1-2H3

InChIKey

GJQIMXVRFNLMTB-UHFFFAOYSA-N

Smiles

C(CCCCCC)CCOC(C)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral > 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 11, Pg. 95, 1973.
rat LD50 skin > 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 11, Pg. 95, 1973.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -2.60E+01 deg C   EXP
Boiling Point 210 deg C   EXP
log P (octanol-water) 4.300 (none)   EST
Atmospheric OH Rate Constant 1.17E-11 cm3/molecule-sec 25 EST

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