Bisphenol A bis(2-hydroxyethyl)ether supplier

Name
4,4'-ISOPROPYLIDENEBIS(2-PHENOXYETHANOL)
EINECS 212-985-6
CAS No. 901-44-0
Article Data18
CAS DataBase
Density 1.135 g/cm³
Solubility 111.8mg/L
Melting Point 112℃
Formula C₁₉H₂₄O₄
Boiling Point 494.958 °C at 760 mmHg
Molecular Weight 316.397
Flash Point 253.142 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Ethanol,2,2'-[isopropylidenebis(p-phenyleneoxy)]di- (6CI,7CI,8CI);1,1'-Isopropylidenebis(p-phenyleneoxy-2-ethanol);2,2-Bis(4-b-hydroxyethoxyphenyl)propane;2,2-Bis[4-(2-hydroxyethoxy)phenyl]propane;2,2-Bis[p-(2-hydroxyethoxy)phenyl]propane;2,2-Bis[p-(b-hydroxyethoxy)phenyl]propane;2,2'-[Isopropylidenebis(p-phenyleneoxy)]diethanol;4,4'-Bis(hydroxyethoxy)diphenyldimethylmethane;4,4'-Bis(hydroxyethyl)bisphenol A;AE 2;AE 2 (diol);Dianol 22;Koremul BSA 20;NSC 60933;Newpol BPE 20;Newpol BPE 20T;Simulsol BPLE;SINOPOL BA3;Ethoxylated Bis phenol A;Ethoxylated Bisphenol A;
PSA 58.92000
LogP 2.75470

Synthetic route

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

: 80-05-7
BPA

: 901-44-0
dyanol 22

Conditions

Conditions	Yield
at 150℃; for 8h; Inert atmosphere;	99%
With potassium carbonate In N,N-dimethyl-formamide at 145℃; for 3h;	65%

With tetraethylammonium iodide
With triethylamine at 105℃; for 24h;

: 75-21-8
oxirane

: 80-05-7
BPA

A: 2065-16-9
4-(2-(4-(2-hydroxyethoxy)phenyl)propan-2-yl)phenol

B: 901-44-0
dyanol 22

Conditions

Conditions	Yield
triethylamine In acetone at 130℃; for 0.416667h; Thermodynamic data; Kinetics; Product distribution; other time, other temperature, activation energy;	A 97% B n/a

...Expand

: 75-21-8
oxirane

: 80-05-7
BPA

: 901-44-0
dyanol 22

Conditions

Conditions	Yield
triethylamine In acetone at 130℃; for 0.416667h;	97%

: 80-05-7
BPA

: 107-21-1
ethylene glycol

: 901-44-0
dyanol 22

Conditions

Conditions	Yield
Stage #1: BPA; ethylene glycol; sodium carbonate at 100℃; Stage #2: With urea; zinc(II) oxide at 175℃; for 2h; Product distribution / selectivity;	88%
With sodium carbonate; urea; zinc(II) oxide at 170 - 190℃;	83%

: 75-21-8
oxirane

: 80-05-7
BPA

A: 57383-53-6
BPA-3EO

B: 2065-16-9
4-(2-(4-(2-hydroxyethoxy)phenyl)propan-2-yl)phenol

C: 901-44-0
dyanol 22

Conditions

Conditions	Yield
anion exchange resin A (Cl-type) In methanol at 100℃; for 9h;	A 1 %Chromat. B 0.1 %Chromat. C 70%
anion exchange resin A (Cl-type) at 100℃; for 9h;	A 2.6 %Chromat. B 0.3 %Chromat. C 97.1 %Chromat.

...Expand

: 80-05-7
BPA

: 107-07-3
2-chloro-ethanol

: 901-44-0
dyanol 22

Conditions

Conditions	Yield
With sodium hydroxide at 0 - 20℃; for 45h; Addition;	65%
With sodium hydroxide; ethanol
With sodium hydroxide; ethanol

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

: 80-05-7
BPA

parabisphenol A: parabisphenol A

: 901-44-0
dyanol 22

Conditions

Conditions	Yield
With potassium iodide

...Expand

: 80-05-7
BPA

: 2065-16-9
4-(2-(4-(2-hydroxyethoxy)phenyl)propan-2-yl)phenol

: 107-21-1
ethylene glycol

: 901-44-0
dyanol 22

Conditions

Conditions	Yield
With urea; zinc(II) oxide at 180℃; for 2h; Product distribution / selectivity;

...Expand

: 107-21-1
ethylene glycol

polycarbonate: polycarbonate

A: 80-05-7
BPA

B: 2065-16-9
4-(2-(4-(2-hydroxyethoxy)phenyl)propan-2-yl)phenol

C: 901-44-0
dyanol 22

Conditions

Conditions	Yield
sodium carbonate at 180℃; for 0.333333h; Product distribution / selectivity;

...Expand

: 124-04-9
Adipic acid

: 901-44-0
dyanol 22

: C44H54O10

Conditions

Conditions	Yield
In melt at 150 - 180℃; for 10h; Inert atmosphere;	99%

: 111-20-6
1,10-decanedioic acid

: 901-44-0
dyanol 22

: C106H138O22

Conditions

Conditions	Yield
In melt at 150 - 200℃; for 24h; Inert atmosphere;	99%

: 26473-49-4
3-mercaptobutyric acid

: 901-44-0
dyanol 22

: 2,2-bis{4-(3-mercaptobutyloyloxyethoxy)phenyl}propane

Conditions

Conditions	Yield
With toluene-4-sulfonic acid In toluene at 140℃; for 4h;	98.9%

: 124-04-9
Adipic acid

: 901-44-0
dyanol 22

: C69H84O16

Conditions

Conditions	Yield
In melt at 160 - 1680℃; for 21h; Inert atmosphere;	98%

: 111-20-6
1,10-decanedioic acid

: 901-44-0
dyanol 22

: C77H100O16

Conditions

Conditions	Yield
In melt at 160 - 180℃; for 20h; Inert atmosphere;	98%

: 124-04-9
Adipic acid

: 901-44-0
dyanol 22

: C94H114O22

Conditions

Conditions	Yield
In melt at 160 - 200℃; for 28h; Inert atmosphere;	97%

: 901-44-0
dyanol 22

: 106-96-7
propargyl bromide

: 2,2-bis[4-(2-(prop-2-yn-1-yloxy)ethoxy)phenyl]propane

Conditions

Conditions	Yield
Stage #1: dyanol 22 With sodium hydride In ethanol; N,N-dimethyl-formamide at -10 - 0℃; for 1.5h; Williamson Ether Synthesis; Inert atmosphere; Stage #2: propargyl bromide In ethanol; N,N-dimethyl-formamide at 0 - 20℃; for 2.5h; Williamson Ether Synthesis; Inert atmosphere;	87%

: 5670-69-9
1,1'-(2-nitroethene-1,1-diyl)dibenzene

: 901-44-0
dyanol 22

: C47H46N2O8

Conditions

Conditions	Yield
Stage #1: dyanol 22 With sodium hydride In hexane; N,N-dimethyl-formamide at 0℃; for 1h; Inert atmosphere; Stage #2: 1,1'-(2-nitroethene-1,1-diyl)dibenzene In hexane; N,N-dimethyl-formamide at 0 - 20℃; for 4h;	42%

: 140-10-3
(E)-3-phenylacrylic acid

: 901-44-0
dyanol 22

: 2,2-bis-[4-(2-trans-cinnamoyloxy-ethoxy)-phenyl]-propane

Conditions

Conditions	Yield
With benzenesulfonic acid; benzene unter Entfernen des entstehenden Wassers;

: 901-44-0
dyanol 22

: 64-19-7
acetic acid

: 19224-29-4
dianol 22 diacetate

Conditions

Conditions	Yield
Heating;

: 901-44-0
dyanol 22

: 98-59-9
p-toluenesulfonyl chloride

: 167489-80-7
C33H36O8S2

Conditions

Conditions	Yield
With sodium hydroxide In tetrahydrofuran at 0 - 5℃; for 3h; Tosylation;

poly(butylene terephthalate), Mn 15000 Da, Mw 34000 Da: poly(butylene terephthalate), Mn 15000 Da, Mw 34000 Da

: 901-44-0
dyanol 22

poly(butylene terephthalate-co-2,2-bis[4-(2-hydroxyethoxy)phenyl]propane), butylene terephthalate content 96 mol %, prepared by melt polymerization: poly(butylene terephthalate-co-2,2-bis[4-(2-hydroxyethoxy)phenyl]propane), butylene terephthalate content 96 mol %, prepared by melt polymerization

Conditions

Conditions	Yield
Heating;

poly(butylene terephthalate), Mn 15000 Da, Mw 34000 Da: poly(butylene terephthalate), Mn 15000 Da, Mw 34000 Da

: 901-44-0
dyanol 22

poly(butylene terephthalate-co-2,2-bis[4-(2-hydroxyethoxy)phenyl]propane), butylene terephthalate content 90 mol %, prepared by melt polymerization: poly(butylene terephthalate-co-2,2-bis[4-(2-hydroxyethoxy)phenyl]propane), butylene terephthalate content 90 mol %, prepared by melt polymerization

Conditions

Conditions	Yield
Heating;

poly(butylene terephthalate), Mn 15000 Da, Mw 34000 Da: poly(butylene terephthalate), Mn 15000 Da, Mw 34000 Da

: 901-44-0
dyanol 22

poly(butylene terephthalate-co-2,2-bis[4-(2-hydroxyethoxy)phenyl]propane), butylene terephthalate content 81 mol %, prepared by melt polymerization: poly(butylene terephthalate-co-2,2-bis[4-(2-hydroxyethoxy)phenyl]propane), butylene terephthalate content 81 mol %, prepared by melt polymerization

Conditions

Conditions	Yield
Heating;

poly(butylene terephthalate), Mn 15000 Da, Mw 34000 Da: poly(butylene terephthalate), Mn 15000 Da, Mw 34000 Da

: 901-44-0
dyanol 22

poly(butylene terephthalate-co-2,2-bis[4-(2-hydroxyethoxy)phenyl]propane), butylene terephthalate content 74 mol %, prepared by melt polymerization: poly(butylene terephthalate-co-2,2-bis[4-(2-hydroxyethoxy)phenyl]propane), butylene terephthalate content 74 mol %, prepared by melt polymerization

Conditions

Conditions	Yield
Heating;

poly(butylene terephthalate), Mn 15000 Da, Mw 34000 Da: poly(butylene terephthalate), Mn 15000 Da, Mw 34000 Da

: 901-44-0
dyanol 22

poly(butylene terephthalate-co-2,2-bis[4-(2-hydroxyethoxy)phenyl]propane), butylene terephthalate content 70 mol %, prepared by melt polymerization: poly(butylene terephthalate-co-2,2-bis[4-(2-hydroxyethoxy)phenyl]propane), butylene terephthalate content 70 mol %, prepared by melt polymerization

Conditions

Conditions	Yield
Heating;

poly(butylene terephthalate), Mn 15000 Da, Mw 34000 Da: poly(butylene terephthalate), Mn 15000 Da, Mw 34000 Da

: 901-44-0
dyanol 22

poly(butylene terephthalate-co-2,2-bis[4-(2-hydroxyethoxy)phenyl]propane), butylene terephthalate content 96 mol %, prepared by solid state polymerization: poly(butylene terephthalate-co-2,2-bis[4-(2-hydroxyethoxy)phenyl]propane), butylene terephthalate content 96 mol %, prepared by solid state polymerization

Conditions

Conditions	Yield
at 180℃; for 9h;

poly(butylene terephthalate), Mn 15000 Da, Mw 34000 Da: poly(butylene terephthalate), Mn 15000 Da, Mw 34000 Da

: 901-44-0
dyanol 22

poly(butylene terephthalate-co-2,2-bis[4-(2-hydroxyethoxy)phenyl]propane), butylene terephthalate content 90 mol %, prepared by solid state polymerization: poly(butylene terephthalate-co-2,2-bis[4-(2-hydroxyethoxy)phenyl]propane), butylene terephthalate content 90 mol %, prepared by solid state polymerization

Conditions

Conditions	Yield
at 180℃; for 9h;

poly(butylene terephthalate), Mn 15000 Da, Mw 34000 Da: poly(butylene terephthalate), Mn 15000 Da, Mw 34000 Da

: 901-44-0
dyanol 22

poly(butylene terephthalate-co-2,2-bis[4-(2-hydroxyethoxy)phenyl]propane), butylene terephthalate content 84 mol %, prepared by solid state polymerization: poly(butylene terephthalate-co-2,2-bis[4-(2-hydroxyethoxy)phenyl]propane), butylene terephthalate content 84 mol %, prepared by solid state polymerization

Conditions

Conditions	Yield
at 180℃; for 9h;

poly(butylene terephthalate), Mn 15000 Da, Mw 34000 Da: poly(butylene terephthalate), Mn 15000 Da, Mw 34000 Da

: 901-44-0
dyanol 22

poly(butylene terephthalate-co-2,2-bis[4-(2-hydroxyethoxy)phenyl]propane), butylene terephthalate content 76 mol %, prepared by solid state polymerization: poly(butylene terephthalate-co-2,2-bis[4-(2-hydroxyethoxy)phenyl]propane), butylene terephthalate content 76 mol %, prepared by solid state polymerization

Conditions

Conditions	Yield
at 180℃; for 9h;

poly(butylene terephthalate), Mn 15000 Da, Mw 34000 Da: poly(butylene terephthalate), Mn 15000 Da, Mw 34000 Da

: 901-44-0
dyanol 22

poly(butylene terephthalate-co-2,2-bis[4-(2-hydroxyethoxy)phenyl]propane), butylene terephthalate content 69 mol %, prepared by solid state polymerization: poly(butylene terephthalate-co-2,2-bis[4-(2-hydroxyethoxy)phenyl]propane), butylene terephthalate content 69 mol %, prepared by solid state polymerization

Conditions

Conditions	Yield
at 180℃; for 9h;

Bisphenol A bis(2-hydroxyethyl)ether Specification

The Ethanol,2,2'-[(1-methylethylidene)bis(4,1-phenyleneoxy)]bis-, with the CAS registry number 901-44-0, is also known as 2,2'-[2,2-Propanediylbis(4,1-phenyleneoxy)]diethanol. Its EINECS registry number is 212-985-6. This chemical's molecular formula is C₁₉H₂₄O₄ and molecular weight is 316.39. What's more, its IUPAC name is called 2-[4-[2-[4-(2-Hydroxyethoxy)phenyl]propan-2-yl]phenoxy]ethanol.

Physical properties about Ethanol,2,2'-[(1-methylethylidene)bis(4,1-phenyleneoxy)]bis- are: (1)ACD/LogP: 3.264; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.26; (4)ACD/LogD (pH 7.4): 3.26; (5)ACD/BCF (pH 5.5): 178.07; (6)ACD/BCF (pH 7.4): 178.07; (7)ACD/KOC (pH 5.5): 1420.95; (8)ACD/KOC (pH 7.4): 1420.95; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 10; (12)Polar Surface Area: 58.92 Å²; (13)Index of Refraction: 1.56; (14)Molar Refractivity: 90.098 cm³; (15)Molar Volume: 278.736 cm³; (16)Surface Tension: 43.57 dyne/cm; (17)Density: 1.135 g/cm³; (18)Flash Point: 253.142 °C; (19)Enthalpy of Vaporization: 80.293 kJ/mol; (20)Boiling Point: 494.958 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O(c1ccc(cc1)C(c2ccc(OCCO)cc2)(C)C)CCO
(2) InChI: InChI=1S/C19H24O4/c1-19(2,15-3-7-17(8-4-15)22-13-11-20)16-5-9-18(10-6-16)23-14-12-21/h3-10,20-21H,11-14H2,1-2H3
(3) InChIKey: UUAGPGQUHZVJBQ-UHFFFAOYSA-N

Product Name

4,4'-ISOPROPYLIDENEBIS(2-PHENOXYETHANOL)

Synthetic route

Bisphenol A bis(2-hydroxyethyl)ether Specification

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