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4-tert-butyl-1-pentyl-2,6,7-trioxabicyclo[2.2.2]octane

4-tert-butyl-1-pentyl-2,6,7-trioxabicyclo[2.2.2]octane structure

CAS No:
97720-30-4
Formula:
C14H26O3
Chemical Name:
4-tert-butyl-1-pentyl-2,6,7-trioxabicyclo[2.2.2]octane
Synonyms:
Orthohexanoic acid, cyclic ester with 2-tert-butyl-2-(hydroxymethyl)-1,3-propanediol;97720-30-4;1-Pentyl-4-tert-butylbicycloorthocarboxylate;2,6,7-Trioxabicyclo(2.2.2)octane, 4-(1,1-dimethylethyl)-1-pentyl-;DTXSID20243199

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4-tert-butyl-1-pentyl-2,6,7-trioxabicyclo[2.2.2]octane Basic Attributes

Molecular Weight：

242.35 g/mol

Exact Mass：

242.18819469 g/mol

DSSTox ID：

DTXSID20243199

Characteristics

PSA：

27.7 Å²

Computed Properties

Molecular Weight:242.35
XLogP3:3.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:242.18819469
Monoisotopic Mass:242.18819469
Topological Polar Surface Area:27.7
Heavy Atom Count:17
Complexity:243
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-tert-butyl-1-pentyl-2,6,7-trioxabicyclo[2.2.2]octane

Basic Attributes
Characteristics
Computed Properties

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