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498-00-0

Basic Information
CAS No.: 498-00-0
Name: 4-Hydroxy-3-methoxybenzyl alcohol
Article Data: 165
Molecular Structure:
Molecular Structure of 498-00-0 (4-Hydroxy-3-methoxybenzyl alcohol)
Formula: C8H10O3
Molecular Weight: 154.166
Synonyms: Vanillylalcohol (6CI,8CI);3-Methoxy-4-hydroxybenzyl alcohol;4-(Hydroxymethyl)-2-methoxyphenol;4-Hydroxy-3-methoxybenzenemethanol;NSC 3993;V 0018;V 0018 (alcohol);Vanillicalcohol;Vanillin alcohol;p-(Hydroxymethyl)guaiacol;Benzenemethanol,4-hydroxy-3-methoxy-;
EINECS: 207-852-4
Density: 1.226 g/cm3
Melting Point: 110-117 ºC(lit.)
Boiling Point: 313.1 ºC at 760 mmHg
Flash Point: 143.2ºC
Solubility: Soluble in 95% ethanol (5 %), water, and oils.
Appearance: crystalline white to off-white powder
Hazard Symbols: IrritantXi
Risk Codes: R36/37/38   
Safety: 26-36
PSA: 49.69000
LogP: 0.89310
Synthetic route

C32H36BO12(1-)*Na(1+)

498-00-0

4-hydroxymethyl-2-methoxyphenol

Conditions
ConditionsYield
With water100%
121-33-5

vanillin

A

93-51-6

2-Methoxy-4-methylphenol

B

498-00-0

4-hydroxymethyl-2-methoxyphenol

Conditions
ConditionsYield
With hydrogen In water at 70℃; Catalytic behavior;A 99.9%
B n/a
With hydrogen In water at 20 - 100℃; under 3750.38 Torr; for 1h; Kinetics; Reagent/catalyst; Temperature; Pressure; Autoclave;A 90.9%
B 9.1%
With 2 wt% Pd/C; hydrogen In water at 20 - 100℃; under 3750.38 Torr; for 1h; Kinetics; Reagent/catalyst; Autoclave;A 21.8%
B 78.3%
1135-24-6

3-(4-hydroxy-3-methoxyphenyl)acrylic acid

498-00-0

4-hydroxymethyl-2-methoxyphenol

Conditions
ConditionsYield
With whole cells of recombinant strain VA1 In aq. phosphate buffer at 30℃; for 24h; pH=7.4; Temperature; Microbiological reaction;99.2%
121-33-5

vanillin

498-00-0

4-hydroxymethyl-2-methoxyphenol

Conditions
ConditionsYield
With sodium tetrahydroborate In methanol for 1h;98%
With aluminum oxide; zinc(II) tetrahydroborate In tetrahydrofuran at 20℃; for 0.08h; chemoselective reaction;97%
With water; nickel dichloride; zinc In N,N-dimethyl-formamide for 2h; Ambient temperature;95%
121-34-6

3-methoxy-4-hydroxybenzoic acid

498-00-0

4-hydroxymethyl-2-methoxyphenol

Conditions
ConditionsYield
With sodium tetrahydroborate; Trimethyl borate; dimethyl sulfate In tetrahydrofuran at 20℃; for 1.5h;98%
With diisopropoxytitanium(III) tetrahydroborate In dichloromethane for 4h; Ambient temperature;73%
With D-glucose In aq. phosphate buffer at 30℃; for 29h; pH=8; Enzymatic reaction;69%
With hydrogen In aq. phosphate buffer at 50℃; under 3750.38 Torr; for 24h; pH=2; Autoclave;
1058649-06-1

2-methoxy-4-((methoxymethoxy)methyl) phenol

498-00-0

4-hydroxymethyl-2-methoxyphenol

Conditions
ConditionsYield
With 1-methylimidazole hydrogen sulfate at 120℃; for 0.025h; Microwave irradiation; chemoselective reaction;95%
phosphotungstic acid In ethanol for 4h; Heating;81%

2-((3-methoxy-4-((4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)oxy)benzyl)oxy)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

498-00-0

4-hydroxymethyl-2-methoxyphenol

Conditions
ConditionsYield
With silica gel In methanol at 60℃; for 3h; Inert atmosphere;95%
86534-11-4

3-methoxy-4-(2-propenyloxy) benzenemethanol

498-00-0

4-hydroxymethyl-2-methoxyphenol

Conditions
ConditionsYield
With cerium(III) chloride; sodium iodide In acetonitrile for 6h; deallylation; Heating;94%
1058649-10-7

4-((ethoxymethoxy)methyl)-2-methoxy phenol

498-00-0

4-hydroxymethyl-2-methoxyphenol

Conditions
ConditionsYield
With 1-methylimidazole hydrogen sulfate at 120℃; for 0.0333333h; Microwave irradiation; chemoselective reaction;93%
phosphotungstic acid In ethanol for 3h; Heating;91%

2-methoxy-1-methoxymethoxy-4-methoxymethoxymethyl-benzene

498-00-0

4-hydroxymethyl-2-methoxyphenol

Conditions
ConditionsYield
bismuth(lll) trifluoromethanesulfonate In tetrahydrofuran; water at 20℃; for 0.5h;90%
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Chemistry

IUPAC Name: 4-(Hydroxymethyl)-2-methoxyphenol 
Empirical Formula: C8H10O3
Molecular Weight: 154.1632g/mol
EINECS: 207-852-4 
Structure of 4-Hydroxy-3-methoxybenzyl alcohol (CAS NO.498-00-0):

Index of Refraction: 1.57
Molar Refractivity: 41.26 cm3
Molar Volume: 125.6 cm3
Polarizability: 16.35×10-24cm3
Surface Tension: 48.9 dyne/cm
Density: 1.226 g/cm3
Flash Point: 143.2 °C
Enthalpy of Vaporization: 58.51 kJ/mol 
Melting Point: 110-117 °C(lit.)
Boiling Point: 313.1 °C at 760 mmHg
Vapour Pressure: 0.000216 mmHg at 25 °C 
Stability: Stable. Incompatible with strong oxidizing agents, strong acids. 
Product Categories: Benzhydrols, Benzyl & Special Alcohols 
Canonical SMILES: COC1=C(C=CC(=C1)CO)O
InChI: InChI=1S/C8H10O3/c1-11-8-4-6(5-9)2-3-7(8)10/h2-4,9-10H,5H2,1H3
InChIKey: ZENOXNGFMSCLLL-UHFFFAOYSA-N

Safety Profile

Safety Information of 4-Hydroxy-3-methoxybenzyl alcohol (CAS NO.498-00-0):
Hazard Codes: IrritantXi
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36:Wear suitable protective clothing.
WGK Germany: 3
Hazard Note: Irritant

Specification

  4-Hydroxy-3-methoxybenzyl alcohol , its cas register number is 498-00-0. It also can be called 4-Hydroxy-3-methoxybenzenemethanol ; 4-Hydroxy-3-methoxybenzyl alcohol ; 4-Hydroxy-3-methoxyphenylmethanol ; AI3-24186 ; Benzenemethanol, 4-hydroxy-3-methoxy- ; Vanillic alcohol ; Vanillin alcohol ; Vanillyl alcohol . 4-Hydroxy-3-methoxybenzyl alcohol (CAS NO.498-00-0) is crystalline white to off-white powder .

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