3',4'-Bis(pivaloyloxy)acetophenone

HCID 12876186
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Basic information

Standard SMILES
CC(=O)c1ccc(OC(=O)C(C)(C)C)c(OC(=O)C(C)(C)C)c1
InChIKey
BFRBDTFKEWEQLJ-UHFFFAOYSA-N
Molecular formula
C18H24O5
Average molar mass
320.4 g/mol
Monoisotopic mass
320.16237386

Names & identifiers

Preferred name
3',4'-Bis(pivaloyloxy)acetophenone
IUPAC
[4-acetyl-2-(2,2-dimethylpropanoyloxy)phenyl] 2,2-dimethylpropanoate

Names & synonyms

SCHEMBL11110607BFRBDTFKEWEQLJ-UHFFFAOYSA-N3',4'-bis(pivaloyloxy)acetophenone

Database identifiers

PubChem CID
12876186

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
69.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
7
Heavy atoms
23

Related reactions

4 records
New reaction record

Compound notes

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