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

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

CAS No:
97719-91-0
Formula:
C15H19ClO3
Chemical Name:
4-butyl-1-(4-chlorophenyl)-2,6,7-trioxabicyclo[2.2.2]octane
Synonyms:
Orthobenzoic acid, p-chloro-, cyclic ester with 2-butyl-2-(hydroxymethyl)-1,3-propanediol;97719-91-0;4-Butyl-1-(4-chlorophenyl)bicycloorthocarboxylate;p-Chloroorthobenzoic acid cyclic ester with 2-butyl-2-(hydroxymethyl)-1,3-propanediol;2,6,7-Trioxabicyclo(2.2.2)octane, 4-butyl-1-(4-chlorophenyl)-;SCHEMBL9667383;DTXSID50243162;1-butyl-4-(4-chlorophenyl)-3,5,8-trioxabicyclo[2.2.2]octane

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4-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：

DTXSID50243162

Characteristics

PSA：

27.7 Å²

Computed Properties

Molecular Weight:282.76
XLogP3:3.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:282.1022722
Monoisotopic Mass:282.1022722
Topological Polar Surface Area:27.7
Heavy Atom Count:19
Complexity:288
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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

Basic Attributes
Characteristics
Computed Properties

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