chempirical

10-Nitroanthrone

C14H9NO3CAS 6313-44-6239.23 g/mol

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Properties

Molecular formula
C14H9NO3
Molar mass
239.23 g/mol
Exact mass
239.0582 Da
logP
2.60Crippen estimate
Polar surface area
60.2 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
6313-44-6
SMILES
C1=CC=C2C(=C1)C(C3=CC=CC=C3C2=O)[N+](=O)[O-]
InChIKey
UWLBXNSHGLMXLU-UHFFFAOYSA-N
InChI
InChI=1S/C14H9NO3/c16-14-11-7-3-1-5-9(11)13(15(17)18)10-6-2-4-8-12(10)14/h1-8,13H

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Names and synonyms

1 names
  • 9-Nitroanthrone

Work with 10-Nitroanthrone

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1-Nitroanthraquinone82-34-845 % similar Anthraquinone84-65-145 % similar 1,8-Dinitro-9,10-anthracenedione129-39-544 % similar 1,5-Dinitro-9,10-anthracenedione82-35-941 % similar Bianthrone434-85-541 % similar Fluorenone486-25-941 % similar 6,13-Pentacenequinone3029-32-139 % similar 1-Hydroxy-4-nitroanthraquinone81-65-238 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

1-Amino-4-hydroxyanthraquinone116-85-8 2-(2-Hydroxyphenyl)-4H-1,3-benzoxazin-4-one1218-69-5

Elsewhere

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