1-tert-Butylanthracene-9,10-dione

HCID 14274944CAS 37808-19-8
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Basic information

Standard SMILES
CC(C)(C)c1cccc2c1C(=O)c1ccccc1C2=O
InChIKey
BGJQNPIOBWKQAW-UHFFFAOYSA-N
Molecular formula
C18H16O2
Average molar mass
264.3 g/mol
Monoisotopic mass
264.11502975

Names & identifiers

Preferred name
1-tert-Butylanthracene-9,10-dione
IUPAC
1-tert-butylanthracene-9,10-dione

Names & synonyms

t-butyl anthraquinone1-tert-Butylanthracene-9,10-dione37808-19-8tert.-butyl anthraquinonetertiary butylanthraquinone1-tert-butyl-anthraquinoneSCHEMBL50547DTXSID10558360BGJQNPIOBWKQAW-UHFFFAOYSA-N9,10-Anthracenedione, 2- (1,1-dimethylethyl)-

Database identifiers

CAS
37808-19-8
PubChem CID
14274944
DTXSID
DTXSID10558360
Nikkaji
J813.868K

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
34.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
20

Experimental & physicochemical properties

SpringerMaterials PropertiesChemical shift

Related reactions

4 records
New reaction record

Linked notes

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