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1-Benzo[1,3]dioxol-5-yl-cyclopropanecarbonitrile

1-Benzo[1,3]dioxol-5-yl-cyclopropanecarbonitrile structure

CAS No:
33522-14-4
Formula:
C11H9NO2
Chemical Name:
1-Benzo[1,3]dioxol-5-yl-cyclopropanecarbonitrile
Synonyms:
1-Benzo[1,3]dioxol-5-yl-cyclopropanecarbonitrile;1-(Benzo[d][1,3]dioxol-5-yl)cyclopropanecarbonitrile;1-(1,3-Benzodioxol-5-yl)cyclopropanecarbonitrile;1-(3,4-Methylenedioxyphenyl)cyclopropanecarbonitrile

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1-Benzo[1,3]dioxol-5-yl-cyclopropanecarbonitrile Basic Attributes

Molecular Weight：

187.197

Exact Mass：

187.06300

NSC Number：

134316

DSSTox ID：

DTXSID80300015

HScode：

2932999099

Characteristics

PSA：

42.2

XLogP3：

1.97048

Density：

1.331g/cm3

Boiling Point：

347.046ºC at 760 mmHg

Flash Point：

146.158ºC

Refractive Index：

1.618

Computed Properties

Molecular Weight:187.19
XLogP3:1.9
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:187.063328530
Monoisotopic Mass:187.063328530
Topological Polar Surface Area:42.2
Heavy Atom Count:14
Complexity:289
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-Benzo[1,3]dioxol-5-yl-cyclopropanecarbonitrile

Basic Attributes
Characteristics
Computed Properties

1-Benzo[1,3]dioxol-5-yl-cyclopropanecarbonitrile

SDS

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