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Substance Name: n-Amyl acetate
RN: 628-63-7
UNII: 92Q24NH7AS
InChIKey: PGMYKACGEOXYJE-UHFFFAOYSA-N

Note

  • Sources do not specify n-isomer.

Molecular Formula

  • C7-H14-O2

Molecular Weight

  • 130.186
 

Classification Codes

Classification Codes

  • Human Data
  • Skin / Eye Irritant

Superlist Classification Codes

  • Reportable Quantity (RQ) = 5000 lb
  • TWA (50 ppm); STEL (100 ppm)
  • TWA 100 ppm (525 mg/m3)

Names and Synonyms

Name of Substance

  • Acetic acid, pentyl ester
  • Amyl acetate
  • n-Amyl acetate

Synonyms

  • 1-Pentanol acetate
  • 1-Pentyl acetate
  • 4-02-00-00152 (Beilstein Handbook Reference)
  • Acetate d'amyle
  • Acetate d'amyle [French]
  • Acetic acid, amyl ester
  • Acetic acid, pentyl ester
  • AI3-02729
  • Amyl acetate
  • Amyl acetic ester
  • Amyl acetic ether
  • Amylazetat
  • Amylazetat [German]
  • Amylester kyseliny octove
  • Amylester kyseliny octove [Czech]
  • Banana oil
  • Birnenoel
  • BRN 1744753
  • Caswell No. 049A
  • Chlordantoin
  • Dymon SWH Wasp & Hornet Spray
  • EINECS 211-047-3
  • EPA Pesticide Chemical Code 000169
  • Holiday Pet Repellent
  • Holiday Repellent Dust
  • HSDB 5126
  • n-Amyl acetate
  • n-Amyl acetate, normal
  • n-Amyl acetate, normal (natural)
  • n-Pentyl acetate
  • n-Pentyl ethanoate
  • NSC 7923
  • Octan amylu
  • Octan amylu [Polish]
  • Pear oil
  • Pent-acetate
  • Pent-acetate 28
  • Pentyl acetate
  • Prim-amyl acetate
  • Primary amyl acetate
  • UNII-92Q24NH7AS

Systematic Names

  • Acetic acid, pentyl ester
  • Pentyl acetate

Superlist Names

  • Acetic acid, pentyl ester
  • Amyl acetate
  • Amyl acetate (commercial)
  • Amyl acetate, n-
  • Amyl acetates
  • Amyl acetates [UN1104] [Flammable liquid]
  • n-Amyl acetate
  • n-Pentyl acetate
  • Pentyl acetate
  • Pentyl acetate, all isomers
  • UN1104

Registry Numbers

CAS Registry Number

  • 628-63-7

FDA UNII

  • 92Q24NH7AS

System Generated Number

  • 0000628637

Structure Descriptors

InChI

1S/C7H14O2/c1-3-4-5-6-9-7(2)8/h3-6H2,1-2H3

InChIKey

PGMYKACGEOXYJE-UHFFFAOYSA-N

Smiles

C(OC(C)=O)CCCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LDLo intraperitoneal 1500mg/kg (1500mg/kg)   American Industrial Hygiene Association Journal. Vol. 35, Pg. 21, 1974.
human TCLo inhalation 5000mg/m3/30M (5000mg/m3) SENSE ORGANS AND SPECIAL SENSES: CONJUNCTIVE IRRITATION: EYE

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES
Archiv fuer Hygiene. Vol. 78, Pg. 260, 1913.
rabbit LD50 oral 7400mg/kg (7400mg/kg)   "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986Vol. -, Pg. 357, 1986.
rat LC inhalation > 3000ppm/6H (3000ppm)   National Technical Information Service. Vol. OTS0558878,
rat LD50 oral > 1600mg/kg (1600mg/kg)   National Technical Information Service. Vol. OTS0556694,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -7.08E+01 deg C   EXP
Boiling Point 149.2 deg C   EXP
log P (octanol-water) 2.3 (none)   EXP
Water Solubility 1700 mg/L 20 EXP
Vapor Pressure 3.5 mm Hg 25 EXP
Henry's Law Constant 3.88E-04 atm-m3/mole 25 EXP
Atmospheric OH Rate Constant 7.55E-12 cm3/molecule-sec 25 EXP

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