Methyl 3-(3-tert-butyl-4-hydroxy-5-isopropylphenyl)propionate

HCID 20043870

Basic information

Standard SMILES
COC(=O)CCc1cc(C(C)C)c(O)c(C(C)(C)C)c1
InChIKey
GLARGGTVHPWLCZ-UHFFFAOYSA-N
Molecular formula
C17H26O3
Average molar mass
278.4 g/mol

Names & identifiers

Preferred name
Methyl 3-(3-tert-butyl-4-hydroxy-5-isopropylphenyl)propionate
IUPAC
methyl 3-(3-tert-butyl-4-hydroxy-5-propan-2-ylphenyl)propanoate

Names & synonyms

SCHEMBL9419534GLARGGTVHPWLCZ-UHFFFAOYSA-Nmethyl 3-(3-tert-butyl-4-hydroxy-5-isopropylphenyl)propionatemethyl 3-(3-tertbutyl-4-hydroxy-5-isopropylphenyl)propionate

Database identifiers

PubChem CID
20043870

Properties

Computed structural properties

XLogP
4.4
Topological polar surface area
46.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
20

Related reactions

3 records

Compound notes

Loading…