1,4-Bis(p-octyloxybenzylidene amino)anthraquinone

HCID 20163337
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Basic information

Standard SMILES
CCCCCCCCOc1ccc(C=Nc2ccc(N=Cc3ccc(OCCCCCCCC)cc3)c3c2C(=O)c2ccccc2C3=O)cc1
InChIKey
GDTCRPIFFWGRNE-UHFFFAOYSA-N
Molecular formula
C44H50N2O4
Average molar mass
670.9 g/mol

Names & identifiers

Preferred name
1,4-Bis(p-octyloxybenzylidene amino)anthraquinone
IUPAC
1,4-bis[(4-octoxyphenyl)methylideneamino]anthracene-9,10-dione

Names & synonyms

SCHEMBL10728002GDTCRPIFFWGRNE-UHFFFAOYSA-N1,4-bis(p-octyloxybenzylidene amino)anthraquinone

Database identifiers

PubChem CID
20163337

Properties

Computed structural properties

XLogP
12.2
Topological polar surface area
77.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
20
Heavy atoms
50

Related reactions

2 records
New reaction record

Linked notes

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