Fluorene

• CAS: 86-73-7
• Catalog Number: ACM86737
• Category: Arenes
• Molecular Weight: 166.22
• Molecular Formula: C13H10
• Description: Fluorene , or 9H-fluorene, is a polycyclic aromatic hydrocarbon. It forms White crystals that exhibit a characteristic, aromatic odor similar to that of naphthalene. It is combustible. It has a violet fluorescence, hence its name. For commercial purposes it is obtained from coal tar. It is insoluble in water and soluble in many organic solvents.
• Synonyms: 9H-Fluorene
• IUPAC Name: 9H-fluorene
• Canonical SMILES: C1C2=CC=CC=C2C3=CC=CC=C31
• InChI: InChI=1S/C13H10/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12/h1-8H,9H2
• InChI Key: NIHNNTQXNPWCJQ-UHFFFAOYSA-N
• Boiling Point: 563 °F at 760 mm Hg (NTP, 1992);295.0 °C;294 °C
• Melting Point: 112-116ºC
• Flash Point: 151ºC
• Density: 1.203
• Solubility: Insoluble. (1.7mg/kg) (NTP, 1992);1.14e-05 M;In water, 1.69 mg/L at 25 °C;Insoluble in water;Freely soluble in glacial acetic acid; soluble in hot alcohol;Slightly soluble in ethanol; soluble in ethyl ether, acetone, benzene, carbon disulfide;Soluble in carbon tetrachloride, toluene, glacial acetic acid, pyridine; very soluble in methanol;Soluble in acetone
• Appearance: White flakes
• Color/Form: Leaflets from alcohol;Dazzling white leaflets or flakes from alcohol;Small, white, crystalline plates; fluorescent when impure
• Complexity: 165
• Covalently-Bonded Unit Count: 1
• Decomposition: Hazardous decomposition products formed under fire conditions - Carbon oxides.
• Defined Atom Stereocenter Count: 0
• EC Number: 201-695-5
• Exact Mass: 166.0782
• Formal Charge: 0
• Hazard Codes: Xi; Xn; T; F; N
• Hazard Statements: H410 : Very toxic to aquatic life with long lasting effects.
• H-Bond Acceptor: 0
• H-Bond Donor: 0
• Heat of Vaporization: 13,682.8 g cal/g mol
• Heavy Atom Count: 13
• HS Code: 2902909090
• Hydrogen Bond Acceptor Count: 0
• Hydrogen Bond Donor Count: 0
• Isotope Atom Count: 0
• LogP: 3.25780
• MDL Number: MFCD00001111
• Monoisotopic Mass: 166.0782
• NSC Number: 6787
• Other Experimental: MP: 116-117 °C;BP: 295 °C (sublimes);Sublimes easily in high vacuum;Photo oxidation by UV in aqueous medium at 90-95 °C: time for the formation of CO2 (% of theoretical): 25%: 75.3 hr; 50%: 160.6 hr; 75%: 297.4 hr.;Henry's Law constant = 9.62X10-5 atm-cu m/mole at 25 °C;Hydroxyl radical reaction rate constant = 1.30X10-11 cu cm/molec-sec at 25 °C
• Precautionary Statements: P501 : Dispose of contents/ container to an approved waste disposal plant.P273 : Avoid release to the environment.P391 : Collect spillage.
• Refractive Index: 1.645
• RIDADR: UN 3077
• Rotatable Bond Count: 0
• Signal Word: Warning
• Stability: Stable. Combustible. Incompatible with strong oxidizing agents.
• Storage Conditions: APPROX 4ºC
• Symbol: GHS07
• Topological Polar Surface Area: 0 Ų
• UNII: 3Q2UY0968A
• UN Number: 3077
• Vapor Pressure: 10 mm Hg at 294.8 °F (NTP, 1992);6.00e-04 mmHg;6.0X10-4 mm Hg at 25 °C
• WGK Germany: 3
• XLogP3: 4.2
• XLogP3-AA: 4.2

Custom Q&A

What is the molecular formula of fluorene?

The molecular formula of fluorene is C13H10.

What is the molecular weight of fluorene?

The molecular weight of fluorene is 166.22 g/mol.

What is the IUPAC name of fluorene?

The IUPAC name of fluorene is 9H-fluorene.

What is the InChI of fluorene?

The InChI of fluorene is InChI=1S/C13H10/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12/h1-8H,9H2.

What is the InChIKey of fluorene?

The InChIKey of fluorene is NIHNNTQXNPWCJQ-UHFFFAOYSA-N.

What is the canonical SMILES of fluorene?

The canonical SMILES of fluorene is C1C2=CC=CC=C2C3=CC=CC=C31.

What is the CAS number of fluorene?

The CAS number of fluorene is 86-73-7.

What is another identifier for fluorene?

Another identifier for fluorene is UNII: 3Q2UY0968A.

What is the ChEMBL ID for fluorene?

The ChEMBL ID for fluorene is CHEMBL16236.

What is the Wikipedia page for fluorene?

The Wikipedia page for fluorene is "Fluorene".