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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 Segment

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

wgk

WGK 2

flash_point_f

150.8 °F - closed cup

flash_point_c

66 °C - closed cup

Storage Class

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

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

Substances Subject to be Indicated Names

ishl_indicated

Substances Subject to be Notified Names

ishl_notified

Class I Designated Chemical Substances

prtr

Group 4: Flammable liquids + Type 2 petroleums + Hazardous rank III + Water insoluble liquid

fsl

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