4-Acetoxy-2,3,5-trimethyl-6-butoxymethyl-1-hydroxybenzene

HCID 11033262
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Basic information

Standard SMILES
CCCCOCc1c(C)c(OC(C)=O)c(C)c(C)c1O
InChIKey
STNJHGWHLFFJKC-UHFFFAOYSA-N
Molecular formula
C16H24O4
Average molar mass
280.36 g/mol
Monoisotopic mass
280.16745924

Names & identifiers

Preferred name
4-Acetoxy-2,3,5-trimethyl-6-butoxymethyl-1-hydroxybenzene
IUPAC
[3-(butoxymethyl)-4-hydroxy-2,5,6-trimethylphenyl] acetate

Names & synonyms

SCHEMBL7529561STNJHGWHLFFJKC-UHFFFAOYSA-N4-acetoxy-2,3,5-trimethyl-6-butoxymethyl-1-hydroxybenzene

Database identifiers

PubChem CID
11033262

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
55.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
20

Related reactions

9 records
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Compound notes

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