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5-Ethynyl-1,3-benzodioxole

5-Ethynyl-1,3-benzodioxole structure

CAS No:
57134-53-9
Formula:
C9H6O2
Chemical Name:
5-Ethynyl-1,3-benzodioxole
Synonyms:
1,3-Benzodioxole,5-ethynyl-;5-Ethynyl-1,3-benzodioxole;3,4-Methylenedioxyphenylacetylene;5-Ethynylbenzodioxole;Benzo[1,3]dioxol-5-ylacetylene;5-Ethynylbenzo[d][1,3]dioxole

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5-Ethynyl-1,3-benzodioxole Basic Attributes

Molecular Weight：

146.14 g/mol

Exact Mass：

146.14

EC Number：

260-583-4

DSSTox ID：

DTXSID60205771

Characteristics

PSA：

18.5 Å²

Boiling Point：

80-82 °C @ Press: 2 Torr

Computed Properties

Molecular Weight:146.14
XLogP3:2.2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:146.036779430
Monoisotopic Mass:146.036779430
Topological Polar Surface Area:18.5
Heavy Atom Count:11
Complexity:191
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-Ethynyl-1,3-benzodioxole

Basic Attributes
Characteristics
Computed Properties

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