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Name	2-Propanol,1,1'-[(1-methylethylidene)bis(4,1-phenyleneoxy)]bis-	EINECS	204-137-9
CAS No.	116-37-0	Density	1.102 g/cm³
PSA	58.92000	LogP	3.53170
Solubility	109mg/L at 20℃	Melting Point	N/A
Formula	C₂₁H₂₈O₄	Boiling Point	505.4 °C at 760 mmHg
Molecular Weight	344.451	Flash Point	259.5 °C
Transport Information	N/A	Appearance	N/A
Safety		Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	2-Propanol,1,1'-[isopropylidenebis(p-phenyleneoxy)]di- (7CI,8CI);1,1'-Isopropylidenebis[4-(2-hydroxypropoxy)benzene];1,1'-[Isopropylidenebis(p-phenyleneoxy)]di-2-propanol;2,2-Bis[4-(2-hydroxy-2-methylethoxy)phenyl]propane;2,2-Bis[4-(2-hydroxypropoxy)phenyl]propane;2,2-Bis[p-(2-hydroxy-2-methylethoxy)phenyl]propane;2,2-Bis[p-(2-hydroxypropoxy)phenyl]propane;2,2-Bis[p-(b-hydroxypropoxy)phenyl]propane;Bisphenol A bis(2-hydroxypropyl) ether;Bisphenol A bis(b-hydroxypropyl) ether;Dianol 33;Isopropylidenediphenoxypropanol;NSC 408494;	Article Data	5

2-Propanol,1,1'-[(1-methylethylidene)bis(4,1-phenyleneoxy)]bis- Synthetic route

: 1675-54-3
diphenylolpropane diglycidyl ether

: 116-37-0
Bisphenol A propoxylate

Conditions

Conditions	Yield
With [carbonylchlorohydrido{bis[2-(diphenylphosphinomethyl)ethyl]amino}ethylamino] ruthenium(II); potassium tert-butylate; hydrogen In toluene at 75℃; under 37503.8 Torr; for 24h; regioselective reaction;	99%

: 80-05-7
BPA

: 75-56-9, 16033-71-9
methyloxirane

A: 116-37-0
Bisphenol A propoxylate

B: 57372-69-7
4-(2-(4-(2-hydroxypropoxy)phenyl)propan-2-yl)phenol

C: 210979-67-2
BPA-3PO

Conditions

Conditions	Yield
anion exchange resin A (OH-type) In 2-methoxy-ethanol at 100℃; for 6h;	A 99 %Chromat. B 0.1 %Chromat. C 0.8 %Chromat.

: 57-55-6
propylene glycol

: 123-31-9
hydroquinone

A: 116-37-0
Bisphenol A propoxylate

B: 1003045-91-7
2-(4-(2-(4-(2-hydroxypropoxy)phenyl)propan-2-yl)phenoxy)propan-1-ol

Conditions

Conditions	Yield
With sodium carbonate; urea; zinc(II) oxide at 170 - 190℃;

: 80-05-7
BPA

: 75-56-9, 16033-71-9
methyloxirane

: 116-37-0
Bisphenol A propoxylate

Conditions

Conditions	Yield
Stage #1: BPA With sodium hydroxide In tetrahydrofuran at 20℃; for 3h; Inert atmosphere; Stage #2: methyloxirane In tetrahydrofuran Inert atmosphere;

: 108-32-7
1,2-propylene cyclic carbonate

: 80-05-7
BPA

A: 116-37-0
Bisphenol A propoxylate

B: 1003045-91-7
2-(4-(2-(4-(2-hydroxypropoxy)phenyl)propan-2-yl)phenoxy)propan-1-ol

Conditions

Conditions	Yield
With potassium hydroxide Inert atmosphere; Heating;

: 116-37-0
Bisphenol A propoxylate

: 26473-49-4
3-mercaptobutyric acid

: 2,2-bis[4-{2-(3-mercaptobutyloyloxy)-2-methylethoxy}phenyl]propane

Conditions

Conditions	Yield
With toluene-4-sulfonic acid In toluene at 140℃; for 4h;	95.1%

: 116-37-0
Bisphenol A propoxylate

: sulfuric acid mono-[1-methyl-2-(4-{1-methyl-1-[4-(2-sulfooxy-propoxy)-phenyl]-ethyl}-phenoxy)-ethyl] ester; compound with ammonia

Conditions

Conditions	Yield
Stage #1: Bisphenol A propoxylate With pyridine; sulfuric acid; acetic anhydride at 50 - 55℃; for 0.5h; Stage #2: With ammonium hydroxide at 0℃; for 0.25h;

: 116-37-0
Bisphenol A propoxylate

: 83697-84-1
(E,E)-2-cyanohexa-2,4-dienoic acid

: 274695-40-8
2,2-Bis-[p-(2-(2-Cyano-2,4-hexadienoyl)-oxypropoxy)-phenyl]-propane

Conditions

Conditions	Yield
With 2,6-di-tert-butyl-4-methyl-phenol In acetone

: 116-37-0
Bisphenol A propoxylate

: 922-15-6
methyl (α-chloromethyl)acrylate

: C31H40O8

Conditions

Conditions	Yield
Stage #1: Bisphenol A propoxylate With 2,6-di-tert-butyl-4-methyl-phenol; sodium hydride In tetrahydrofuran for 2h; Inert atmosphere; Stage #2: methyl (α-chloromethyl)acrylate In tetrahydrofuran at 20℃; Inert atmosphere;

2-Propanol,1,1'-[(1-methylethylidene)bis(4,1-phenyleneoxy)]bis- Specification

The 2-Propanol,1,1'-[(1-methylethylidene)bis(4,1-phenyleneoxy)]bis- is an organic compound with the formula C₂₁H₂₈O₄. The IUPAC name of this chemical is 1-[4-[2-[4-(2-hydroxypropoxy)phenyl]propan-2-yl]phenoxy]propan-2-ol. With the CAS registry number 116-37-0, it is also named as 1,1'-[Propane-2,2-diylbis(4,1-phenyleneoxy)]dipropan-2-ol.

Physical properties about 2-Propanol,1,1'-[(1-methylethylidene)bis(4,1-phenyleneoxy)]bis- are: (1)ACD/LogP: 3.48; (2)ACD/LogD (pH 5.5): 3.48; (3)ACD/LogD (pH 7.4): 3.48; (4)ACD/BCF (pH 5.5): 259.99; (5)ACD/BCF (pH 7.4): 259.99; (6)ACD/KOC (pH 5.5): 1863.06; (7)ACD/KOC (pH 7.4): 1863.06; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 10; (11)Polar Surface Area: 36.92 Å²; (12)Index of Refraction: 1.548; (13)Molar Refractivity: 99.28 cm³; (14)Molar Volume: 312.5 cm³; (15)Polarizability: 39.35×10^-24cm³; (16)Surface Tension: 40.9 dyne/cm; (17)Density: 1.102 g/cm³; (18)Flash Point: 259.5 °C; (19)Enthalpy of Vaporization: 81.61 kJ/mol; (20)Boiling Point: 505.4 °C at 760 mmHg; (21)Vapour Pressure: 4.9E-11 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O(c1ccc(cc1)C(c2ccc(OCC(O)C)cc2)(C)C)CC(O)C
(2)InChI: InChI=1/C21H28O4/c1-15(22)13-24-19-9-5-17(6-10-19)21(3,4)18-7-11-20(12-8-18)25-14-16(2)23/h5-12,15-16,22-23H,13-14H2,1-4H3
(3)InChIKey: MIUUNYUUEFHIHM-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C21H28O4/c1-15(22)13-24-19-9-5-17(6-10-19)21(3,4)18-7-11-20(12-8-18)25-14-16(2)23/h5-12,15-16,22-23H,13-14H2,1-4H3
(5)Std. InChIKey: MIUUNYUUEFHIHM-UHFFFAOYSA-N

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD	intraperitoneal	> 500mg/kg (500mg/kg)		"Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. Vol. 5, Pg. 340, 1953.

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