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3-(2-Propen-1-yloxy)propanenitrile

3-(2-Propen-1-yloxy)propanenitrile structure

CAS No:
3088-44-6
Formula:
C6H9NO
Chemical Name:
3-(2-Propen-1-yloxy)propanenitrile
Synonyms:
Propanenitrile,3-(2-propen-1-yloxy)-;Propionitrile,3-(allyloxy)-;Propanenitrile,3-(2-propenyloxy)-;3-(2-Propen-1-yloxy)propanenitrile;Allyl β-cyanoethyl ether;2-Cyanoethyl allyl ether;Allyl 2-cyanoethyl ether;3-(Allyloxy)propionitrile;3-(2-Propenyloxy)propionitrile;NSC 2291;3-Allyloxy propane-1-nitrile

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3-(2-Propen-1-yloxy)propanenitrile Basic Attributes

Molecular Weight：

111.14

Exact Mass：

111.14

UNII：

UV31GJR23O

NSC Number：

2291

DSSTox ID：

DTXSID30184887

HScode：

2926909090

Characteristics

PSA：

XLogP3：

1.10268

Density：

0.927 g/cm³ @ Temp: 25 °C

Boiling Point：

114 °C @ Press: 50 Torr

Flash Point：

82.9ºC

Refractive Index：

1.423

Toxicity：

Peritoneal-mouse LD50: 500 mg/kg; oral-rat LD50: 1.3 ml/kg

Flammability characteristics：

Flammable; burning produces nitrogen oxides and cyanide fumes

Safety Information

hazard class code：

36/37/38

safety instructions：

26-36/37/39

Storage features：

Treasury is ventilated, low temperature and dry; stored separately from food materials

Toxicity

Toxicity class：

moderately toxic

Computed Properties

Molecular Weight:111.14
XLogP3:0.4
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:111.068413911
Monoisotopic Mass:111.068413911
Topological Polar Surface Area:33
Heavy Atom Count:8
Complexity:100
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(2-Propen-1-yloxy)propanenitrile

Basic Attributes
Characteristics
Safety Information
Toxicity
Computed Properties

3-(2-Propen-1-yloxy)propanenitrile

SDS

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