Bisphenoxyethanolfluorene supplier

Name
Bisphenoxyethanolfluorene
EINECS 672-704-1
CAS No. 117344-32-8
Article Data16
CAS DataBase
Density 1.248 g/cm³
Solubility Insoluble in water
Melting Point 117-120 °C(lit.)
Formula C₂₉H₂₆O₄
Boiling Point 610.7 °C at 760 mmHg
Molecular Weight 438.523
Flash Point 323.1 °C
Transport Information
Appearance
Safety 26-36
Risk Codes 37
Molecular Structure
Hazard Symbols Xi
Synonyms 9,9-Bis[4-(2-hydroxyethoxy)phenyl]fluorene;BPEF;BPHE;2,2'-[9H-fluorene-9,9-diylbis(benzene-4,1-diyloxy)]diethanol;2,2'-[9H-Fluorene-9,9-diylbis(4,1-phenyleneoxy)]diethanol;ethanol, 2,2'-[9H-fluoren-9-ylidenebis(4,1-phenyleneoxy)]bis-;2-(4-{9-[4-(2-Hydroxy-ethoxy)-phenyl]-9H-fluoren-9-yl}-phenoxy)-ethanol;4,4'-(9-Fluorenylidene)bis(2-phenoxyethanol);4,4′-(9-Fluorenylidene)bis(2-phenoxyethanol);9,9-Bis[4-(2-hydroxyethoxy)phenyl]fluorene;
PSA 58.92000
LogP 4.79190

Synthetic route

: 122-99-6
2-Phenoxyethanol

: 486-25-9
9-fluorenone

: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

Conditions

Conditions	Yield
With sulfuric acid; ethanethiol for 12h; Reagent/catalyst; Reflux;	94.5%
With 3-mercaptopropionic acid In chlorobenzene at 115℃; for 2h; Solvent; Temperature; Reagent/catalyst;	92.5%
tungstophosphoric acid In toluene at 130℃; under 15.0015 Torr; for 4h; Product distribution / selectivity; Inert atmosphere;	90.2%

: 75-21-8
oxirane

: 3236-71-3
9,9-bis(4-hydroxyphenyl)fluorene

: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

Conditions

Conditions	Yield
With potassium hydroxide In water; isopropyl alcohol at 30 - 65℃; for 6.83333h; Solvent; Temperature; Reagent/catalyst;	91.5%

: 96-49-1
[1,3]-dioxolan-2-one

: 3236-71-3
9,9-bis(4-hydroxyphenyl)fluorene

: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

Conditions

Conditions	Yield
With potassium fluoride In N,N-dimethyl-formamide for 4h; Inert atmosphere; Reflux;	75%
With potassium fluoride In N,N-dimethyl-formamide for 4h; Inert atmosphere; Reflux;	75%

: 75-21-8
oxirane

: 3236-71-3
9,9-bis(4-hydroxyphenyl)fluorene

A: BPF

B: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

Conditions

Conditions	Yield
anion exchange resin A (Cl-type) In 2-methoxy-ethanol at 100℃; for 12h;	A 2.0 %Chromat. B 98.0 %Chromat.

...Expand

: 56101-99-6
phenoxyethyl alcohol

: 486-25-9
9-fluorenone

: 108-95-2
phenol

: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

...Expand

: 486-25-9
9-fluorenone

: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: 3-mercaptopropionic acid; methanesulfonic acid / toluene / 13 h / 40 °C / Inert atmosphere 2: potassium fluoride / N,N-dimethyl-formamide / 4 h / Inert atmosphere; Reflux View Scheme

: 108-95-2
phenol

: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: 3-mercaptopropionic acid; methanesulfonic acid / toluene / 13 h / 40 °C / Inert atmosphere 2: potassium fluoride / N,N-dimethyl-formamide / 4 h / Inert atmosphere; Reflux View Scheme

: 122-99-6
2-Phenoxyethanol

: 25023-01-2
9,9-dichloro-9H-fluorene

: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

Conditions

Conditions	Yield
Stage #1: 2-Phenoxyethanol; 9,9-dichloro-9H-fluorene at 70℃; for 3h; Inert atmosphere; Stage #2: With methanesulfonic acid at 110℃; for 9h; Inert atmosphere;	13.5 g

: 106-89-8
epichlorohydrin

: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

: 9,9-bis[4-(2,3-epoxypropoxyethoxy)phenyl]fluorene

Conditions

Conditions	Yield
With calcium chloride; sodium hydroxide at 65℃; Green chemistry;	98.8%
With N-benzyl-N,N,N-triethylammonium chloride at 60℃; for 1h;
With N-benzyl-N,N,N-triethylammonium chloride at 60℃; for 1h;

: 26473-49-4
3-mercaptobutyric acid

: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

: 9,9-bis{4-(3-mercaptobutyloyloxyethoxy)phenyl}fluorene

Conditions

Conditions	Yield
With toluene-4-sulfonic acid In toluene at 140℃; for 3h;	97.1%

: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

: C29H24Cl2O2

Conditions

Conditions	Yield
With pyridine; thionyl chloride In tetrahydrofuran at 60℃; for 4h; Inert atmosphere;	95%
With pyridine; thionyl chloride In tetrahydrofuran at 60℃; for 4h; Inert atmosphere;	95%
With pyridine; thionyl chloride In tetrahydrofuran at 60℃; for 4h; Inert atmosphere;	95%

: 98-59-9
p-toluenesulfonyl chloride

: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

: 1203647-68-0
C43H38O8S2

Conditions

Conditions	Yield
With triethylamine In tetrahydrofuran at 0 - 20℃; for 120h;	93%

: 104-49-4
1,4-diisocyanatobenzene

: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

: 818-61-1
2-hydroxyethyl acrylate

: C55H50N4O14

Conditions

Conditions	Yield
Stage #1: 1,4-diisocyanatobenzene; 9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene With dibutyltin(II) dilaurate; 4-methoxy-phenol In toluene at 40 - 95℃; for 3h; Inert atmosphere; Stage #2: 2-hydroxyethyl acrylate In toluene at 40 - 95℃; for 2h; Inert atmosphere;	88%

...Expand

: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

: 4695-31-2
2-mercapto-2-methylpropanoic acid

: 9,9-bis{4-(2-mercaptoisobutyloyloxyethoxy)phenyl}fluorene

Conditions

Conditions	Yield
With toluene-4-sulfonic acid In toluene at 140℃; for 4h;	86.8%

: 814-68-6
acryloyl chloride

: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

: 9,9-bis[4-(2-acryloyloxyethoxy)phenyl]fluorene

Conditions

Conditions	Yield
With triethylamine In acetone at 0 - 20℃; for 6.5h;	83.6%

: 50-99-7
D-glucose

: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

A: 9-[4-(2-hydroxyethoxy)phenyl]-9-[4-(2-glucosyloxyethoxy)phenyl]fluorene

B: 9-[4-(2-hydroxyethoxy)phenyl]-9-{4-[2-(2-formyl-5-furylmethoxy)ethoxy]phenyl}fluorene

C: 9-[4-(2-hydroxyethoxy)phenyl]-9-{4-[2-(4-oxopentanoyloxy)ethoxy]phenyl}fluorene

Conditions

Conditions	Yield
With sulfuric acid at 200℃; for 1h; Temperature; Reagent/catalyst;	A 0.7% B n/a C 73.6%

...Expand

: 79-10-7
acrylic acid

: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

: 9,9-bis[4-(2-acryloyloxyethoxy)phenyl]fluorene

Conditions

Conditions	Yield
With methanesulfonic acid In benzene for 12h; Inert atmosphere; Reflux; Dean-Stark;	65%
With methanesulfonic acid In benzene for 12h; Dean-Stark; Inert atmosphere; Reflux;	65%
With toluene-4-sulfonic acid; 4-methoxy-phenol In toluene at 110 - 115℃;	258.8 g

: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

poly(ethylene terephthalate), Mn 31 kg/mol, Mw 72 kg/mol, PDI 2.3; monomer(s): bis(2-hydroxyethyl) terephthalate: poly(ethylene terephthalate), Mn 31 kg/mol, Mw 72 kg/mol, PDI 2.3; monomer(s): bis(2-hydroxyethyl) terephthalate

polymer, Mn 29 kg/mol, Mw 68 kg/mol, PDI 2.3, fluorene units content 10 percent; monomer(s): bis(2-hydroxyethyl) terephthalate; 4,4\-(9-fluorenylidene)bis(2-phenoxyethanol): polymer, Mn 29 kg/mol, Mw 68 kg/mol, PDI 2.3, fluorene units content 10 percent; monomer(s): bis(2-hydroxyethyl) terephthalate; 4,4\-(9-fluorenylidene)bis(2-phenoxyethanol)

Conditions

Conditions	Yield
With antimony(III) trioxide at 20 - 210℃; under 0.045004 Torr; for 25.5h;

: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

: 1203647-70-4
C67H50O6

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1.1: triethylamine / tetrahydrofuran / 120 h / 0 - 20 °C 2.1: potassium carbonate / N,N-dimethyl-formamide / 80 °C 3.1: n-butyllithium / tetrahydrofuran; hexane / 1.67 h / -78 °C 3.2: -78 - 20 °C View Scheme

: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

: 1203647-69-1
C41H32Br2O4

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: triethylamine / tetrahydrofuran / 120 h / 0 - 20 °C 2: potassium carbonate / N,N-dimethyl-formamide / 80 °C View Scheme

: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

: 74-86-2
acetylene

: 9,9-bis(4-(2-(vinyloxy)ethoxy)phenyl)-9H-fluorene

Conditions

Conditions	Yield
With potassium hydroxide In dimethyl sulfoxide at 100℃; under 300.03 Torr; for 6h; Inert atmosphere;

: 814-68-6
acryloyl chloride

: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

: 920-46-7
Methacryloyl chloride

: C36H32O6

Conditions

Conditions	Yield
Stage #1: acryloyl chloride; 9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene With triethylamine In tetrahydrofuran at 20℃; for 3h; Cooling with ice; Stage #2: Methacryloyl chloride In tetrahydrofuran at 20℃; for 12h;

...Expand

: 458-35-5
coniferol

: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

A: C39H36O6

B: C49H50O9

Conditions

Conditions	Yield
In 1,4-dioxane at 180℃; for 0.5h;

...Expand

: 30674-80-7
2-Isocyanatoethyl methacrylate

: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

: (((((((9H-fluorene-9,9-diyl)bis(4,1-phenylene))bis(oxy))bis(ethane-2,1-diyl))bis(oxy))bis(carbonyl))bis(azanediyl))bis(ethane-2,1-diyl) bis(2-methylacrylate)

Conditions

Conditions	Yield
With stannous octoate In ethyl acetate at 60℃; for 16h;

: 13641-96-8
acrylic acid 2-isocyanatoethyl ester

: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

: (((((((9H-fluorene-9,9-diyl)bis(4,1-phenylene))bis(oxy))bis(ethane-2,1-diyl))bis(oxy))bis(carbonyl))bis(azanediyl))bis(ethane-2,1-diyl) diacrylate

Conditions

Conditions	Yield
With stannous octoate In ethyl acetate at 60℃; for 16h;

: 15396-00-6
3-(trimethoxysilyl)propyl isocyanate

: 117344-32-8
9,9-bis(4-(2-hydroxyethoxy)phenyl)fluorene

: C36H41NO8Si

Conditions

Conditions	Yield
With 1,4-diaza-bicyclo[2.2.2]octane In tetrahydrofuran for 6h; Reflux;

Bisphenoxyethanolfluorene Specification

The Bisphenoxyethanolfluorene, with the CAS registry number 117344-32-8, has the systematic name of 2,2'-[9H-fluorene-9,9-diylbis(benzene-4,1-diyloxy)]diethanol. It belongs to the following product categories: Fluorenes; Fluorenes & Fluorenones; Fluorenes, etc. (reagent for high-performance polymer research); Functional Materials; Reagent for High-Performance Polymer Research; Fluorene series; Alcohols; C9 to C30; Oxygen Compounds. And the molecular formula of the chemical is C₂₉H₂₆O₄.

The characteristics of Bisphenoxyethanolfluorene are as followings: (1)ACD/LogP: 4.14; (2)# of Rule of 5 Violations: 0 ; (3)#H bond acceptors: 4; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 10; (6)Polar Surface Area: 36.92 Å²; (7)Index of Refraction: 1.651; (8)Molar Refractivity: 128.28 cm³; (9)Molar Volume: 351.1 cm³; (10)Polarizability: 50.85×10^-24cm³; (11)Surface Tension: 56.8 dyne/cm; (12)Density: 1.248 g/cm³; (13)Flash Point: 323.1 °C; (14)Enthalpy of Vaporization: 95.35 kJ/mol; (15)Boiling Point: 610.7 °C at 760 mmHg; (16)Vapour Pressure: 9.06E-16 mmHg at 25°C.

You should be cautious while dealing with this chemical. It irritates to respiratory system. Therefore, you had better take the following instructions: Wear suitable protective clothing, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: OCCOc1ccc(cc1)C4(c2ccccc2c3c4cccc3)c5ccc(OCCO)cc5
(2)InChI: InChI=1/C29H26O4/c30-17-19-32-23-13-9-21(10-14-23)29(22-11-15-24(16-12-22)33-20-18-31)27-7-3-1-5-25(27)26-6-2-4-8-28(26)29/h1-16,30-31H,17-20H2
(3)InChIKey: NQXNYVAALXGLQT-UHFFFAOYAJ

Product Name

Bisphenoxyethanolfluorene

Synthetic route

Bisphenoxyethanolfluorene Specification

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