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1-ethynyl-4-propan-2-yl-2,6,7-trioxabicyclo[2.2.2]octane

1-ethynyl-4-propan-2-yl-2,6,7-trioxabicyclo[2.2.2]octane structure

CAS No:
97720-41-7
Formula:
C10H14O3
Chemical Name:
1-ethynyl-4-propan-2-yl-2,6,7-trioxabicyclo[2.2.2]octane
Synonyms:
Orthopropiolic acid, cyclic ester with 2-(hydroxymethyl)-2-isopropyl-1,3-propanediol;97720-41-7;1-Ethynyl-4-isopropylbicycloorthocarboxylate;2,6,7-Trioxabicyclo(2.2.2)octane, 1-ethynyl-4-(1-methylethyl)-;DTXSID50243208

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1-ethynyl-4-propan-2-yl-2,6,7-trioxabicyclo[2.2.2]octane Basic Attributes

Molecular Weight：

182.22 g/mol

Exact Mass：

182.094294304 g/mol

DSSTox ID：

DTXSID50243208

Characteristics

PSA：

27.7 Å²

Computed Properties

Molecular Weight:182.22
XLogP3:0.9
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:182.094294304
Monoisotopic Mass:182.094294304
Topological Polar Surface Area:27.7
Heavy Atom Count:13
Complexity:236
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: ethanolamine; diphosphorus pentoxide formula; so2f2; glibenclamide; dimethyl sulfate; zinc hydroxide

Guide of 1-ethynyl-4-propan-2-yl-2,6,7-trioxabicyclo[2.2.2]octane

Basic Attributes
Characteristics
Computed Properties

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