t-Butyl 4-hydroxy-4-(2-methylphenyl)butanoate

HCID 22010446
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Basic information

Standard SMILES
Cc1ccccc1C(O)CCC(=O)OC(C)(C)C
InChIKey
GDNXDLQAOGCMDD-UHFFFAOYSA-N
Molecular formula
C15H22O3
Average molar mass
250.33 g/mol

Names & identifiers

Preferred name
t-Butyl 4-hydroxy-4-(2-methylphenyl)butanoate
IUPAC
tert-butyl 4-hydroxy-4-(2-methylphenyl)butanoate

Names & synonyms

SCHEMBL7907846GDNXDLQAOGCMDD-UHFFFAOYSA-Nt-butyl 4-hydroxy-4-(2-methylphenyl)butanoatetert-butyl 4-hydroxy-4-(2-methylphenyl)butanoate

Database identifiers

PubChem CID
22010446

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
46.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
18

Related reactions

6 records
New reaction record

Compound notes

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