5,8-Dihydro-5-imino-8-[[4-(phenylmethoxy)phenyl]imino]-1,4-naphthalenedione
Basic information
- CAS
6486-71-1- Standard SMILES
N=c1ccc(=Nc2ccc(OCc3ccccc3)cc2)c2c(=O)ccc(=O)c1=2- InChIKey
QSKFNTNVMWKFCW-UHFFFAOYSA-N- Molecular formula
- C23H16N2O3
- Average molar mass
- 368.4 g/mol
- Monoisotopic mass
- 368.11609238
Names & identifiers
- Preferred name
- 5,8-Dihydro-5-imino-8-[[4-(phenylmethoxy)phenyl]imino]-1,4-naphthalenedione
- IUPAC
- 5-imino-8-(4-phenylmethoxyphenyl)iminonaphthalene-1,4-dione
- English name
- 5,8-Dihydro-5-imino-8-[[4-(phenylmethoxy)phenyl]imino]-1,4-naphthalenedione
- Molecular formula
- C23H16N2O3
- Molecular weight
- 368.38
Names & synonyms
6486-71-15,8-Dihydro-5-imino-8-[[4-(phenylmethoxy)phenyl]imino]-1,4-naphthalenedioneQSKFNTNVMWKFCW-UHFFFAOYSA-NDTXSID801143439AKOS0244347065-{[4-(Benzyloxy)phenyl]imino}-8-imino-5,8-dihydronaphthalene-1,4-dioneC.I.56060Disperse Green 1Disperse Green 3BC.I.Disperse Green 1Celliton Fast Green 3BC.I.Disperse Green 1:C.I.56060
Show more names
5-imino-8-(4-phenylmethoxyphenyl)iminonaphthalene-1,4-dione5,8-Dihydro-5-imino-8-[[4-(phenylmethoxy)phenyl]imino]-1,4-naphthoquinone1,4-Naphthalenedione, 5,8-dihydro-5-imino-8-[[4-(phenylmethoxy)phenyl]imino]-
Database identifiers
- CAS
6486-71-1- PubChem CID
- 4136919
- DTXSID
DTXSID801143439- EC Number
- 613-717-4
- Nikkaji
- J9.597D
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 79.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 789
Chemistry & industry
Preparation methods
Preparation4-Imino-5-hydroxy-8-amino-1(4H)-naphthalenone and 4-(Benzyloxy)benzenaminecondensation, then use air oxidation.
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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