ethyl (3S)-3-hydroxyhexanoate

Name	ethyl 3-hydroxyhexanoate
Synonyms	FEMA 3545 ethyl 3-hydroxyhexanoate ETHYL 3-HYDROXYHEXANOATE ETHYL 3 HYDROXY CAPROATE Ethyl 3-hydroxybhexanoate ethyl (3R)-3-hydroxyhexanoate ethyl (3S)-3-hydroxyhexanoate 3-hydroxy-hexanoicaciethylester Hexanoicacid,3-hydroxy-,ethylester Hexanoic acid, 3-hydroxy-, ethyl ester
CAS	2305-25-1
EINECS	218-973-7
InChI	InChI=1/C8H16O3/c1-3-5-7(9)6-8(10)11-4-2/h7,9H,3-6H2,1-2H3/t7-/m0/s1

Molecular Formula	C8H16O3
Molar Mass	160.21
Density	0.974g/mLat 25°C(lit.)
Boling Point	90-92°C14mm Hg(lit.)
Flash Point	202°F
JECFA Number	601
Vapor Presure	0.00608mmHg at 25°C
Appearance	clear liquid
Color	Colorless to Almost colorless
pKa	14.45±0.20(Predicted)
Storage Condition	Sealed in dry,Room Temperature
Refractive Index	n20/D 1.428(lit.)
Physical and Chemical Properties	Colorless to light yellow liquid. Fruit aroma. Boiling Point 101~102 °c (1866Pa),85~90 °c (1333Pa) or 62 °c (93.3). Insoluble in water and oils. Natural products are found in orange juice, sweet orange oil, grapefruit juice, pineapple, Cornell wine, alcohol, passion fruit, passion fruit juice, Indian Apple, papaya, etc.

Safety Description	24/25 - Avoid contact with skin and eyes.
WGK Germany	3
TSCA	Yes
HS Code	29181990

FEMA	3545 \| ETHYL 3-HYDROXYHEXANOATE
NIST chemical information	Information provided by: webbook.nist.gov (external link)
EPA chemical information	Information provided by: ofmpub.epa.gov (external link)
toxicity	GRAS(FEMA).
usage limit	FEMA(mg/kg): baked goods, breakfast cereals, other cereal products, 5.0; Cold drinks, gelatin jelly, pudding, beverages (containing alcohol and no alcohol), dairy products, fruit ice products, candy, icing, jam, gum sugar, 1.0.
use	GB 2760-96 specifies food spices that are allowed to be used.

Last Update：2024-04-09 15:16:45

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