Anthracene

C₁₄H₁₀CAS 120-12-7178.23 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₄H₁₀
Molar mass: 178.23 g/mol
Exact mass: 178.0783 Da
Density: 1.25 g/mL (at 27 °C)
Melting point: 218 °C
Boiling point: 342 °C
Flash point: 121 °C (closed cup)
Water solubility: 1.29 mg/L (25 °C)
logP: 3.99Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

Hazards

Danger

H315 Causes skin irritation21.1% of notifiers
H319 Causes serious eye irritation97.7% of notifiers
H350 May cause cancer18.5% of notifiers
H400 Very toxic to aquatic life21.1% of notifiers
H410 Very toxic to aquatic life with long lasting effects22.2% of notifiers

Aggregated from 573 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P264, P264+P265, P273, P280, P302+P352, P305+P351+P338, P318, P321, P332+P317, P337+P317, P362+P364, P391, P405, P501

Identifiers

CAS number

120-12-7

SMILES

c1ccc2cc3ccccc3cc2c1

InChIKey

MWPLVEDNUUSJAV-UHFFFAOYSA-N

InChI

InChI=1S/C14H10/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h1-10H

Weigh it out

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

Names and synonyms

6 names

Anthracin
Green oil
Paranaphthalene
Tetra olive N2G
NSC 7958
A 0495

Work with Anthracene

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

(2H10)Anthracene1719-06-8Labelled

Similar compounds

Pentacene135-48-891 % similar Tetracene92-24-091 % similar Naphthalene91-20-364 % similar Benzo[b]triphenylene215-58-760 % similar 9,9′-Bianthryl1055-23-856 % similar 2,3-Dibromonaphthalene13214-70-556 % similar 2,3-Dimethylnaphthalene581-40-856 % similar 2,2'-Binaphthalene612-78-256 % similar

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

Same formula

4-Ethynyl-1,1′-biphenyl29079-00-3 9-Methylene-fluorene4425-82-5 Diphenylacetylene501-65-5 Phenanthrene85-01-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia