(4-Acetyloxy-2,5-ditert-butylphenyl) acetate

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Basic information

CAS: 900-02-7
Standard SMILES: CC(=O)Oc1cc(C(C)(C)C)c(OC(C)=O)cc1C(C)(C)C
InChIKey: WLKNHGFKRADSDX-UHFFFAOYSA-N
Molecular formula: C18H26O4
Average molar mass: 306.4 g/mol
Monoisotopic mass: 306.18310931

Names & identifiers

Preferred name: (4-Acetyloxy-2,5-ditert-butylphenyl) acetate
IUPAC: (4-acetyloxy-2,5-ditert-butylphenyl) acetate

Names & synonyms

(4-acetyloxy-2,5-ditert-butylphenyl) acetate900-02-7DTXSID70323556RefChem:208530DTXCID50274673NSC404291NSC-4042912,5-Di-tert-butyl-1,4-phenylene diacetate

Database identifiers

CAS: 900-02-7
PubChem CID: 346175
DTXSID: DTXSID70323556

Properties

Computed structural properties

XLogP: 4.8
Topological polar surface area: 52.6 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 4
Rotatable bonds: 6
Heavy atoms: 22
Formal charge: 0
Complexity: 374

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Compound notes

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