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Merck
CN

8.05891

3-Methoxypropionitrile

for synthesis

Synonym(s):

3-Methoxypropionitrile, 2-Methoxyethyl cyanide

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About This Item

Empirical Formula (Hill Notation):
C4H7NO
CAS Number:
Molecular Weight:
85.10
UNSPSC Code:
12352117
EC Index Number:
203-790-7
NACRES:
NA.22
MDL number:
Assay:
≥98.0% (GC)
Form:
liquid
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vapor pressure

2.3 hPa ( 30 °C)

Quality Level

assay

≥98.0% (GC)

form

liquid

autoignition temp.

390 °C (DIN 51794)

potency

4130 mg/kg LD50, oral (Rat), >9400 mg/kg LD50, skin (Rabbit)

expl. lim.

1.9-15.3 % (v/v)

pH

6.8 (25 °C, 111 g/L in H2O)

bp

164-165 °C/1013 hPa

mp

-63 °C

transition temp

flash point 66 °C

solubility

540 g/L

density

0.94 g/cm3 at 20 °C

storage temp.

2-30°C

SMILES string

N#CCCOC

InChI

1S/C4H7NO/c1-6-4-2-3-5/h2,4H2,1H3

InChI key

OOWFYDWAMOKVSF-UHFFFAOYSA-N

Analysis Note

Assay (GC, area%): ≥ 98.0 % (a/a)
Density (d 20 °C/ 4 °C): 0.938 - 0.940
Identity (IR): passes test


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pictograms

Exclamation mark

signalword

Warning

hcodes

Hazard Classifications

Eye Irrit. 2

Storage Class

10 - Combustible liquids

wgk

WGK 2

flash_point_f

150.8 °F - closed cup

flash_point_c

66 °C - closed cup



Certificates of Analysis (COA)

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Global Trade Item Number

SKUGTIN
805891010004022536388014
805891050004022536388021