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8.14990

Allyl hexanoate

for synthesis

Synonym(s):

Allyl hexanoate, Allyl caproate, Hexanoic acid allyl ester, Caproic acid allyl ester

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About This Item

Empirical Formula (Hill Notation):
C9H16O2
CAS Number:
123-68-2
Molecular Weight:
156.22
UNSPSC Code:
12352108
EC Index Number:
204-642-4
NACRES:
NA.22
MDL number:
MFCD00038339
Assay:
≥98.0% (GC)
Form:
liquid
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Quality Level

200

assay

≥98.0% (GC)

form

liquid

potency

218 mg/kg LD50, oral (Rat), 300 mg/kg LD50, skin (Rabbit)

transition temp

flash point 74 °C

density

0.887 g/cm3 at 25 °C

storage temp.

2-30°C

SMILES string

O(CC=C)C(=O)CCCCC

InChI

1S/C9H16O2/c1-3-5-6-7-9(10)11-8-4-2/h4H,2-3,5-8H2,1H3

InChI key

RCSBILYQLVXLJG-UHFFFAOYSA-N

Analysis Note

Assay (GC, area%): ≥ 98.0 % (a/a)
Density (d 20 °C/ 4 °C): 0.888 - 0.892
Identity (IR): passes test

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pictograms

Skull and crossbonesEnvironment
GHS06,GHS09

signalword

Danger

Hazard Classifications

Acute Tox. 3 Dermal - Acute Tox. 3 Oral - Aquatic Chronic 2

Storage Class

6.1C - Combustible, acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

wgk

WGK 2

flash_point_f

150.8 °F - closed cup

flash_point_c

66 °C - closed cup

Regulatory Information

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Global Trade Item Number

SKUGTIN
814990025004022536879741