9-Nitroanthracene

C14H9NO2CAS 602-60-8223.23 g/mol

Open in Covalent MOL file
ON+O−
Nitro

Properties

Molecular formula
C14H9NO2
Molar mass
223.23 g/mol
Exact mass
223.0633 Da
Melting point
146 °C
Boiling point
275 °C
Water solubility
< 100 mg/L (17.8 °C)
logP
3.90Crippen estimate
Polar surface area
43.1 Ų
H-bond donors / acceptors
0 / 2
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
602-60-8
SMILES
O=[N+]([O-])c1c2ccccc2cc2ccccc12
InChIKey
LSIKFJXEYJIZNB-UHFFFAOYSA-N
InChI
InChI=1S/C14H9NO2/c16-15(17)14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)14/h1-9H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

3 names
  • Anthracene, 9-nitro-
  • 5-Nitroanthracene
  • NSC 47175

Reactions

Work with 9-Nitroanthracene

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1-Nitro-2-naphthol550-60-761 % similar 2-Methyl-1-nitronaphthalene881-03-861 % similar 1-Nitronaphthalene86-57-760 % similar 1,3-Dichloro-2-nitrobenzene601-88-755 % similar 1,5-Dinitronaphthalene605-71-052 % similar 1,4-Dinitronaphthalene6921-26-252 % similar 2-Nitronaphthalene581-89-550 % similar 4-Nitroisoquinoline36073-93-549 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Aminoanthraquinone117-79-3 1-(Naphthalen-1-yl)-2,5-dihydro-1H-pyrrole-2,5-dione3369-39-9 N-Phenylphthalimide520-03-6 Acridine-9-carboxylic acid5336-90-3 4'-Cyano[1,1'-biphenyl]-4-carboxylic acid5728-46-1 1-Phenylisatin723-89-7 1-Aminoanthraquinone82-45-1 3-Phenyl-2,1-benzisoxazole-5-carbaldehyde94752-06-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook