9-Fluorenone - CAS 486-25-9

Name: 9-Fluorenone
Brand: BOC Sciences
Rating: 5 (1 reviews)

Technical Data

IUPAC Name:	fluoren-9-one
Description:	9-Fluorenone (CAS# 486-25-9) is a polycyclic aromatic ketone that has photosensitizing properties and also has the ability to undergo electrochemical polymerization. 9-Fluorenone is used in industry as an initiator in visible-light cured resin systems. 9-Fluorenone has potentially toxic effects on humans, as exposure can cause DNA mutations.
Molecular Weight:	180.20
Molecular Formula:	C13H8O
Canonical SMILES:	C1=CC=C2C(=C1)C3=CC=CC=C3C2=O
InChI:	InChI=1S/C13H8O/c14-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)13/h1-8H
InChI Key:	YLQWCDOCJODRMT-UHFFFAOYSA-N
Boiling Point:	342 °C
Melting Point:	81-85 °C
Flash Point:	163 °C
Purity:	95 %
Density:	0.9 g/cm³
Solubility:	Insol in water; sol in alcohol, Acetone, Benzene; very sol in ether, Toluene, Hot benzene
Appearance:	Yellow crystalline powder
Storage:	Store at RT.
MDL:	MFCD00001141
LogP:	2.89800
Vapor Pressure:	0.0000572 [mmHg]

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CN-113480722-A	Polycarbonate and preparation method and application thereof	20210806
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CN-113429399-A	Pyrene derivative, light emitting device material and light emitting device	20210710
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CN-113292529-A	Method for synthesizing spirofluorene xanthene based on microreactor	20210622

PMID	Publication Date	Title	Journal
23043542	20121105	Do solid-state structures reflect Lewis acidity trends of heavier group 13 trihalides? Experimental and theoretical case study	Inorganic chemistry
23046082	20121019	Preparation and rearrangement of N-vinyl nitrones: synthesis of spiroisoxazolines and fluorene-tethered isoxazoles	Organic letters
22966807	20121003	A tunable route for the synthesis of azomethine imines and β-aminocarbonyl compounds from alkenes	Journal of the American Chemical Society
22938567	20120921	Synthesis of fluorenone derivatives through Pd-catalyzed dehydrogenative cyclization	Organic letters
22850944	20120914	Modular electron donor group tuning of frontier energy levels in diarylaminofluorenone push-pull molecules	Physical chemistry chemical physics : PCCP

Complexity:	222
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	180.057514874
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	180.057514874
Rotatable Bond Count:	0
Topological Polar Surface Area:	17.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.6