Megaphone acetate B811608K130

HCID 324151

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Basic information

CAS: 64332-38-3
Standard SMILES: C=CCC1(C(C)C(OC(C)=O)c2cc(OC)c(OC)c(OC)c2)CC(OC)C=CC1=O
InChIKey: ACAKNZGFODMHDA-UHFFFAOYSA-N
Molecular formula: C24H32O7
Average molar mass: 432.5 g/mol
Monoisotopic mass: 432.21480336

Names & identifiers

Preferred name: Megaphone acetate B811608K130
IUPAC: [2-(5-methoxy-2-oxo-1-prop-2-enylcyclohex-3-en-1-yl)-1-(3,4,5-trimethoxyphenyl)propyl] acetate

Names & synonyms

MEGAPHONE ACETATE B811608K13064332-38-3DTXSID60314776NSC288409NSC-2884092-[5-Methoxy-2-oxo-1-(prop-2-en-1-yl)cyclohex-3-en-1-yl]-1-(3,4,5-trimethoxyphenyl)propyl acetate

Database identifiers

CAS: 64332-38-3
PubChem CID: 324151
DTXSID: DTXSID60314776

Properties

Computed structural properties

XLogP: 3.4
Topological polar surface area: 80.3 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 7
Rotatable bonds: 11
Heavy atoms: 31
Formal charge: 0
Complexity: 646

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