1,7-Dinitroanthraquinone

HCID 74147CAS 1604-43-9
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C1c2ccc([N+](=O)[O-])cc2C(=O)c2c1cccc2[N+](=O)[O-]
InChIKey
FAVDZWIRBSMLOV-UHFFFAOYSA-N
Molecular formula
C14H6N2O6
Average molar mass
298.21 g/mol
Monoisotopic mass
298.02258592

Names & identifiers

Preferred name
1,7-Dinitroanthraquinone
IUPAC
1,7-dinitroanthracene-9,10-dione
English name
1,7-dinitroanthraquinone
Molecular formula
C14H6N2O6
Molecular weight
298.21

Names & synonyms

1,7-Dinitroanthraquinone1,7-dinitroanthracene-9,10-dione1604-43-91,7-Dinitroanthrachinon1,7-Dinitro-9,10-anthracenedioneEINECS 216-514-59,10-Anthracenedione, 1,7-dinitro-1,7-dinitro-anthraquinoneUW926QWY7YSCHEMBL9185849DTXSID60166878STK372701
Show more names
AKOS005447191NS00025226ST51060745

Database identifiers

CAS
1604-43-9
PubChem CID
74147
DTXSID
DTXSID60166878
UNII
UW926QWY7Y
EC Number
216-514-5
Nikkaji
J195.222F

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
126 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
0
Heavy atoms
22

Physicochemical properties

Melting point
270 · 270-290 °C
Boiling point
563.4 · 563.4±50.0 °C(Predicted)
Density
1.631 · 1.631±0.06 g/cm3(Predicted)

Chemistry & industry

Suppliers1 total

陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]

Related reactions

14 records
New reaction record

Linked notes

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