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sec-Amyl acetate

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Not to be confused with Amyl acetate.
sec-Amyl acetate
The structure of sec-amyl acetate
Names
Preferred IUPAC name Pentan-2-yl acetate
Other names 1-Methylbutyl acetate
2-Pentanol acetate
2-Pentyl ester of acetic acid
Identifiers
CAS Number
3D model (JSmol)
ChemSpider
ECHA InfoCard 100.009.952 Edit this at Wikidata
PubChem CID
UNII
CompTox Dashboard (EPA)
InChI
  • InChI=1S/C7H14O2/c1-4-5-6(2)9-7(3)8/h6H,4-5H2,1-3H3Key: GQKZRWSUJHVIPE-UHFFFAOYSA-N
  • InChI=1/C7H14O2/c1-4-5-6(2)9-7(3)8/h6H,4-5H2,1-3H3Key: GQKZRWSUJHVIPE-UHFFFAOYAN
SMILES
  • CCCC(C)OC(C)=O
Properties
Chemical formula C7H14O2
Molar mass 130.187 g·mol
Appearance Colorless liquid
Odor Mild, like bananas
Density 0.87 g/mL (20°C)
Melting point −78 °C; −109 °F; 195 K
Boiling point 121 °C; 249 °F; 394 K
Solubility in water 0.2g/100g water (20°C)
Vapor pressure 7 mmHg (20°C)
Hazards
GHS labelling:
Signal word Warning
Hazard statements H226
Flash point 32 °C; 89 °F; 305 K
Autoignition
temperature
380 °C (716 °F; 653 K)
Explosive limits 1–7.5% (20°C)
Lethal dose or concentration (LD, LC):
LCLo (lowest published) 9200 ppm (guinea pig, 7 hr)
10,000 ppm (guinea pig, 5 hr)
NIOSH (US health exposure limits):
PEL (Permissible) TWA 125 ppm (650 mg/m)
REL (Recommended) TWA 125 ppm (650 mg/m)
IDLH (Immediate danger) 1000 ppm
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). Infobox references
Chemical compound

sec-Amyl acetate is an organic compound and an ester. It is formed in an esterification reaction of sec-amyl alcohol (2-pentanol) and acetic acid. It is a colorless liquid.

References

  1. ^ NIOSH Pocket Guide to Chemical Hazards. "#0032". National Institute for Occupational Safety and Health (NIOSH).
  2. ^ "2-Pentyl Acetate". PubChem. NCBI.
  3. "sec-Amyl acetate". Immediately Dangerous to Life or Health Concentrations (IDLH). National Institute for Occupational Safety and Health (NIOSH).
Esters
Methyl esters
Ethyl esters
Propyl esters
Butyl esters
Amyl esters
Hexyl esters
Phenyl esters
Heptyl esters
Benzyl esters
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