Hexyl acetate Structure

Hexyl acetate

Chemical Properties

Melting point ?80 °C (lit.)
Boiling point 168-170 °C (lit.)
Density  0.87 g/mL at 25 °C (lit.)
vapor pressure  5 hPa (20 °C)
FEMA  2565 | HEXYL ACETATE
refractive index  n20/D 1.409(lit.)
FLAVIS Number 09.006 | Hexyl acetate
Flash point 99 °F
storage temp.  Store below +30°C.
solubility  0.4g/l
form  Liquid
color  Clear colorless to pale yellow
Odor at 10.00 % in dipropylene glycol. fruity green apple banana sweet
Odor Type fruity
Odor Threshold 0.0018ppm
biological source synthetic
Water Solubility  immiscible
Thermal Conductivity 0.129 W/(m·K) at 25 ℃
JECFA Number 128
BRN  1747138
Henry's Law Constant 2.0×10-2 mol/(m3Pa) at 25℃, Brockbank (2013)
Dielectric constant 4.4199999999999999
Major Application flavors and fragrances
Cosmetics Ingredients Functions PERFUMING
FLAVOURING
FRAGRANCE
InChI 1S/C8H16O2/c1-3-4-5-6-7-10-8(2)9/h3-7H2,1-2H3
InChIKey AOGQPLXWSUTHQB-UHFFFAOYSA-N
SMILES CCCCCCOC(C)=O
LogP 3.3 at 30℃
Surface tension 26.75mN/m at 298.15K
Substances Added to Food (formerly EAFUS) HEXYL ACETATE
FDA 21 CFR 172.515
CAS DataBase Reference 142-92-7(CAS DataBase Reference)
EWG's Food Scores 1
FDA UNII 7U7KU3MWT0
NIST Chemistry Reference Hexyl ethanoate(142-92-7)
EPA Substance Registry System Acetic acid, hexyl ester (142-92-7)
UNSPSC Code 85151701
NACRES NA.24

Safety

Symbol(GHS) GHS hazard pictogramsGHS hazard pictograms
Signal wordWarning
Hazard statements H226-H411
Precautionary statements P210-P233-P240-P241-P242-P273
Risk Statements  10
Safety Statements  16
RIDADR  UN 3272 3/PG 3
WGK Germany  1
RTECS  AI0875000
TSCA  TSCA listed
HazardClass  3
PackingGroup  III
HS Code  29153990
Storage Class 3 - Flammable liquids
Hazard Classifications Aquatic Chronic 2
Flam. Liq. 3
Hazardous Substances Data 142-92-7(Hazardous Substances Data)
Toxicity LD50 orally in Rabbit: 36100 mg/kg LD50 dermal Rabbit > 5000 mg/kg
NFPA 704:
2
1 0

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Hexyl acetate Chemical Properties,Usage,Production

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