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4-Isopropenylphenol
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Name

4-Isopropenylphenol

 EINECS N/A
CAS No. 4286-23-1 Density 1.004 g/cm3
PSA 20.23000 LogP 2.42530
Solubility N/A Melting Point 85℃
Formula C9H10O Boiling Point 217.996 °C at 760 mmHg
Molecular Weight 134.178 Flash Point 97.672 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 4286-23-1 (4-Isopropenylphenol) Hazard Symbols N/A
Synonyms

Phenol,p-isopropenyl- (6CI,7CI,8CI);2-(4-Hydroxyphenyl)propene;4-(1-Methylethenyl)phenol;4-(1-Propen-2-yl)phenol;p-Isopropenylphenol;

Article Data 40

4-Isopropenylphenol Synthetic route

80-05-7

BPA

4286-23-1

4-isopropenylphenol

Conditions
ConditionsYield
With sodium hydroxide at 230 - 250℃; under 15 Torr; Pyrolysis;90%
With potassium superoxide; 18-crown-6 ether In N,N-dimethyl-formamide at 25℃; for 35h;30%
With sodium hydroxide (heating);
With sodium hydroxide at 230 - 250℃; Pyrolysis;
1712-69-2

1-isopropenyl-4-methoxybenzene

4286-23-1

4-isopropenylphenol

Conditions
ConditionsYield
With sodium thioethylate In N,N-dimethyl-formamide for 0.5h; Heating;89%
1779-49-3

Methyltriphenylphosphonium bromide

99-93-4

4-Hydroxyacetophenone

4286-23-1

4-isopropenylphenol

Conditions
ConditionsYield
Stage #1: Methyltriphenylphosphonium bromide With sodium hexamethyldisilazane In tetrahydrofuran at 20℃; for 1.5h; Cooling;
Stage #2: 4-Hydroxyacetophenone In tetrahydrofuran for 4h;		14%
Stage #1: Methyltriphenylphosphonium bromide With potassium tert-butylate In tetrahydrofuran at 0℃; for 0.75h;
Stage #2: 4-Hydroxyacetophenone In tetrahydrofuran at 20℃; for 18h;
Stage #1: Methyltriphenylphosphonium bromide With potassium tert-butylate In tetrahydrofuran at 0℃; for 1h; Inert atmosphere;
Stage #2: 4-Hydroxyacetophenone In tetrahydrofuran at 20℃; for 6h; Inert atmosphere;
99-89-8

4-Isopropylphenol

4286-23-1

4-isopropenylphenol

Conditions
ConditionsYield
With chromium corundum at 600℃;
80-05-7

BPA

A

4286-23-1

4-isopropenylphenol

B

108-95-2

phenol

Conditions
ConditionsYield
at 200 - 280℃; Yield given;
With sulfuric acid In water at 250℃; for 0.5h; pH=2.0; Kinetics; Further Variations:; Reagents; pH-values; Temperatures;
With [Fe(IV)(O)(N-benzyl-N,N',N'-tris(2-pyridylmethyl)-1,2-diaminoethane)](2+) In water; acetonitrile at 24.84℃;
80037-90-7

1,1,3,3-tetramethyl-2,3-dihydro-1H-isoindol-2-yloxoyl radical

98-83-9

isopropenylbenzene

A

4286-23-1

4-isopropenylphenol

B

93066-52-5

2-phenyl-3-(1,1,3,3-tetramethylisoindolin-2-yloxy)prop-1-ene

C

97141-97-4

2-phenyl-1-(1,1,3,3-tetramethylisoindolin-2-yloxy)propan-2-ol

D

97141-93-0

2-phenyl-2-(1,1,3,3-tetramethylisoindolin-2-yloxy)propan-1-ol

Conditions
ConditionsYield
With 2-(t-butylazo)prop-2-yl hydroperoxide at 60℃; for 6h; Rate constant; Product distribution; investigation of the reaction of hydroxyl radicals with polymerizable olefins by radical trapping technique; rate constants in competition experiments with cyclohexane;
With 2-(t-butylazo)prop-2-yl hydroperoxide at 60℃; for 6h; in sealed vessel;A 9 % Turnov.
B 5 % Turnov.
C 3 % Turnov.
D 83 % Turnov.
...Expand
98-83-9

isopropenylbenzene

4286-23-1

4-isopropenylphenol

Conditions
ConditionsYield
With phosphate buffer; air; 1,4-dihydronicotinamide adenine dinucleotide at 45℃; methane mono-oxygenase from Methylococcus capsulatus (Bath); Yield given;
55182-48-4

4-Isopropyliden-2,5-cyclohexadienon

4286-23-1

4-isopropenylphenol

Conditions
ConditionsYield
With acetic acid; triethylamine In chloroform
80-05-7

BPA

Fuller's earth

Fuller's earth

A

4286-23-1

4-isopropenylphenol

B

108-95-2

phenol

Conditions
ConditionsYield
at 200 - 230℃;
3-<4-hydroxy-phenyl>-glutaconic acid

3-<4-hydroxy-phenyl>-glutaconic acid

A

4286-23-1

4-isopropenylphenol

B

149636-52-2

p-hydroxy-3-methyl-trans-cinnamic acid

Conditions
ConditionsYield
With water at 150℃;

4-Isopropenylphenol Specification

The Phenol,4-(1-methylethenyl)-, with the CAS registry number 4286-23-1, is also known as 4-Isopropenylphenol. This chemical's molecular formula is C9H10O and molecular weight is 134.1751. What's more, its IUPAC name is called 4-(Prop-1-en-2-yl)phenol.

Physical properties about Phenol,4-(1-methylethenyl)- are: (1)ACD/LogP: 2.72; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.72; (4)ACD/LogD (pH 7.4): 2.71; (5)ACD/BCF (pH 5.5): 68.21; (6)ACD/BCF (pH 7.4): 67.94; (7)ACD/KOC (pH 5.5): 714.94; (8)ACD/KOC (pH 7.4): 712.12; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.546; (14)Molar Refractivity: 42.33 cm3; (15)Molar Volume: 133.6 cm3; (16)Surface Tension: 35.9 dyne/cm; (17)Density: 1.003 g/cm3; (18)Flash Point: 97.7 °C; (19)Enthalpy of Vaporization: 47.29 kJ/mol; (20)Boiling Point: 218 °C at 760 mmHg; (21)Vapour Pressure: 0.0875 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Oc1ccc(\C(=C)C)cc1
(2) InChI: InChI=1/C9H10O/c1-7(2)8-3-5-9(10)6-4-8/h3-6,10H,1H2,2H3
(3) InChIKey: JAGRUUPXPPLSRX-UHFFFAOYAE

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