2-[2-(3-Tert-butyl-phenoxy)-ethyl]-[1,3]dioxane

HCID 59548552
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(C)(C)c1cccc(OCCC2OCCCO2)c1
InChIKey
FPGHHJUUOOBPTP-UHFFFAOYSA-N
Molecular formula
C16H24O3
Average molar mass
264.36 g/mol

Names & identifiers

Preferred name
2-[2-(3-Tert-butyl-phenoxy)-ethyl]-[1,3]dioxane
IUPAC
2-[2-(3-tert-butylphenoxy)ethyl]-1,3-dioxane

Names & synonyms

SCHEMBL696146FPGHHJUUOOBPTP-UHFFFAOYSA-NAKOS0158190332-[2-(3-tert-butyl-phenoxy)-ethyl]-[1,3]dioxane

Database identifiers

PubChem CID
59548552

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
27.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
19

Related reactions

8 records
New reaction record

Linked notes

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