1,8-Bis(p-n-butylbenzylidene amino)anthraquinone

HCID 20163354
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Basic information

Standard SMILES
CCCCc1ccc(C=Nc2cccc3c2C(=O)c2c(N=Cc4ccc(CCCC)cc4)cccc2C3=O)cc1
InChIKey
UTKSFMHUEXPRIW-UHFFFAOYSA-N
Molecular formula
C36H34N2O2
Average molar mass
526.7 g/mol

Names & identifiers

Preferred name
1,8-Bis(p-n-butylbenzylidene amino)anthraquinone
IUPAC
1,8-bis[(4-butylphenyl)methylideneamino]anthracene-9,10-dione

Names & synonyms

SCHEMBL10732297UTKSFMHUEXPRIW-UHFFFAOYSA-N1,8-bis(p-n-butylbenzylidene amino)anthraquinone

Database identifiers

PubChem CID
20163354

Properties

Computed structural properties

XLogP
9.2
Topological polar surface area
58.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
10
Heavy atoms
40

Related reactions

2 records
New reaction record

Compound notes

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