2-Stearamidoethyl 3,4-di-tert-butyl-4-hydroxybenzoate

HCID 70565995
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Basic information

Standard SMILES
CCCCCCCCCCCCCCCCCC(=O)NCCOC(=O)C1=CC(C(C)(C)C)C(O)(C(C)(C)C)C=C1
InChIKey
YZRPKPUVEPOMCZ-UHFFFAOYSA-N
Molecular formula
C35H63NO4
Average molar mass
561.9 g/mol
Monoisotopic mass
561.47570949

Names & identifiers

Preferred name
2-Stearamidoethyl 3,4-di-tert-butyl-4-hydroxybenzoate
IUPAC
2-(octadecanoylamino)ethyl 3,4-ditert-butyl-4-hydroxycyclohexa-1,5-diene-1-carboxylate

Names & synonyms

SCHEMBL11336280YZRPKPUVEPOMCZ-UHFFFAOYSA-N2-Stearamidoethyl 3,4-di-tert-butyl-4-hydroxybenzoate

Database identifiers

PubChem CID
70565995

Properties

Computed structural properties

XLogP
11.4
Topological polar surface area
75.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
23
Heavy atoms
40

Related reactions

1 records
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Compound notes

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