Menoctone
Basic information
- CAS
14561-42-3- Standard SMILES
O=C1C(=O)c2ccccc2C(O)=C1CCCCCCCCC1CCCCC1- InChIKey
MGDIRAXSDLCQGC-UHFFFAOYSA-N- Molecular formula
- C24H32O3
- Average molar mass
- 368.5 g/mol
- Monoisotopic mass
- 368.23514488
Overview
See also: Menoctone (annotation moved to).
Names & identifiers
- Preferred name
- Menoctone
- IUPAC
- 3-(8-cyclohexyloctyl)-4-hydroxynaphthalene-1,2-dione
- English name
- Menoctone
- Molecular formula
- C24H32O3
- Molecular weight
- 368.51
Names & synonyms
MENOCTONE14561-42-3MenoctonaWin 11,5302-(8-Cyclohexyloctyl)-3-hydroxy-1,4-naphthoquinoneWin 11530NSC-1033363-(8-cyclohexyloctyl)-4-hydroxynaphthalene-1,2-dioneWIN-11530NSC 1033362-(8-cyclohexyloctyl)-3-hydroxy-1,4-dihydronaphthalene-1,4-dioneQP1A5BD6K9
Show more names
WR-49808
1,4-Naphthalenedione, 2-(8-cyclohexyloctyl)-3-hydroxy-NSC1033361,4-Naphthoquinone, 2-(8-cyclohexyloctyl)-3-hydroxy-MenoctonumMenottoneMenottone [DCIT]Menoctone [USAN:INN]Menoctonum [INN-Latin]
Database identifiers
- CAS
14561-42-3- PubChem CID
- 26738
- DTXSID
DTXSID60932651- ChEMBL
CHEMBL1999063- UNII
- QP1A5BD6K9
- Nikkaji
- J8.509J
Properties
Computed structural properties
- XLogP
- 7.7
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 542
Physicochemical properties
- FDA UNII
- 1 A5BD6K9 · QP1A5BD6K9
Chemistry & industry
Applications
UsesAntimalarial.
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Related reactions
0 records
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Compound notes
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