N-CAPROIC ACID ISOPROPYL ESTER

CAS No.：2311-46-8

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This product is a chemical product/pharmaceutical intermediate. It is not a drug, an active pharmaceutical ingredient (API), or a pharmaceutical-grade material. It has not been granted a drug approval number or a Chemical Drug Substance Approval Notice, has not passed drug-related review and approval, and is not manufactured, tested, or released in accordance with pharmaceutical GMP.
This product is intended solely for non-clinical research, process development, quality studies, further chemical processing, or chemical synthesis. It must not be used in drug-product manufacturing, clinical trials, clinical diagnosis, or administration to humans or animals, or be sold, used as an input, submitted for regulatory filing, or released as an API or pharmaceutical material.
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N-CAPROIC ACID ISOPROPYL ESTER Basic information

Product Name:	N-CAPROIC ACID ISOPROPYL ESTER
Synonyms:	hexanoicacidisopropylester;n-C5H11C(O)OCH(CH3)2;FEMA 2950;ISOPROPYL HEXANOATE;ISOPROPYL N-HEXANOATE;ISOPROPYL CAPROATE;Isoproyl hexanoate;Isopropyl haxanoate
CAS:	2311-46-8
MF:	C9H18O2
MW:	158.24
EINECS:	219-000-9
Product Categories:
Mol File:	2311-46-8.mol

N-CAPROIC ACID ISOPROPYL ESTER Chemical Properties

Boiling point	168 °C
density	0.86
refractive index	1.4060-1.4080
FEMA	2950 \| ISOPROPYL HEXANOATE
Fp	54 °C
form	clear liquid
color	Colorless to Almost colorless
JECFA Number	308
CAS DataBase Reference	2311-46-8(CAS DataBase Reference)

Safety Information

RIDADR	3272
HazardClass	3
PackingGroup	III

MSDS Information

N-CAPROIC ACID ISOPROPYL ESTER Usage And Synthesis

Description	Isopropyl hexanoate has a sweet, delicate, fruity odor of pineapple and a fresh, sweet, berry-like taste.
Chemical Properties	Isopropyl hexanoate has a sweet, delicate, fruity odor of pineapple; fresh, sweet, berry-like taste
Occurrence	Reported found in strawberry, blue cheese, Parmesan and Gruyere cheese, grapes and starfruit
Preparation	By esterification of hexanoic acid with isopropyl alcohol in benzene solution in the presence of trace amounts of concentrated H2SO4 and subsequent azeotropic distillation

N-CAPROIC ACID ISOPROPYL ESTER Preparation Products And Raw materials

Raw materials	Isopropyl alcohol-->Hexyl hexanoate-->5-HEXENOIC ACID METHYL ESTER-->Hexanoyl chloride-->carbon monoxide-->1-Hexanol-->TRANS-1,3-PENTADIENE-->HEXANOIC ANHYDRIDE-->Hexanoic acid-->Hexanal
Preparation Products	Ethyl Hexanoate

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