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4-tert-butyl-1-(4-chlorophenyl)-2,6,7-trioxabicyclo[2.2.2]octane

4-tert-butyl-1-(4-chlorophenyl)-2,6,7-trioxabicyclo[2.2.2]octane structure

CAS No:
97719-93-2
Formula:
C15H19ClO3
Chemical Name:
4-tert-butyl-1-(4-chlorophenyl)-2,6,7-trioxabicyclo[2.2.2]octane
Synonyms:
Orthobenzoic acid, p-chloro-, cyclic ester with 2-tert-butyl-2-(hydroxymethyl)-1,3-propanediol;97719-93-2;p-Chloroorthobenzoic acid cyclic ester with 2-tert-butyl-2-(hydroxymethyl)-1,3-propanediol;4-tert-Butyl-1-(4-chlorophenyl)bicycloorthocarboxylate;2,6,7-Trioxabicyclo(2.2.2)octane, 1-(4-chlorophenyl)-4-(1,1-dimethylethyl)-;CHEMBL551548;SCHEMBL9667420;DTXSID10243163;1-tert-butyl-4-(4-chlorophenyl)-3,5,8-trioxabicyclo[2.2.2]octane

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

Molecular Weight：

282.76 g/mol

Exact Mass：

282.1022722 g/mol

DSSTox ID：

DTXSID10243163

Characteristics

PSA：

27.7 Å²

Computed Properties

Molecular Weight:282.76
XLogP3:3.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:282.1022722
Monoisotopic Mass:282.1022722
Topological Polar Surface Area:27.7
Heavy Atom Count:19
Complexity:317
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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

Basic Attributes
Characteristics
Computed Properties

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