ChemicalBook--->CAS DataBase List--->623-04-1

623-04-1

623-04-1 Structure

623-04-1 Structure
IdentificationMore
[Name]

4-Aminobenzyl alcohol
[CAS]

623-04-1
[Synonyms]

4-AMINOBENZYL ALCOHOL
4-(HYDROXYMETHYL)ANILINE
P-AMINOBENZYL ALCOHOL
p-Aminobenzenecarbinol
4-Aminobenzylalcohol,98%
(4-Aminophenyl)methanol
4-Aminobenzenemethanol
[EINECS(EC#)]

210-767-5
[Molecular Formula]

C7H9NO
[MDL Number]

MFCD00014782
[Molecular Weight]

123.15
[MOL File]

623-04-1.mol
Chemical PropertiesBack Directory
[Appearance]

white to light yellow crystal powde
[Melting point ]

60-65 °C(lit.)
[Boiling point ]

171°C/11mmHg(lit.)
[density ]

1.0877 (rough estimate)
[refractive index ]

1.5380 (estimate)
[storage temp. ]

2-8°C
[solubility ]

Chloroform (Soluble), Methanol (Slightly)
[form ]

Crystalline Powder
[pka]

14.82±0.10(Predicted)
[color ]

Yellow to brown
[Stability:]

Stable, but air and light sensitive. Incompatible with strong oxidizing agents, strong acids. Combustible.
[Water Solubility ]

Soluble in alcohol, ether and benzene. Partially soluble in water.
[Sensitive ]

Air Sensitive
[BRN ]

2078680
[InChIKey]

AXKGIPZJYUNAIW-UHFFFAOYSA-N
[CAS DataBase Reference]

623-04-1(CAS DataBase Reference)
[Storage Precautions]

Air sensitive
Questions And AnswerBack Directory
[Synthesis]

The catalytic reduction of 4-aldehyde nitrobenzene to 4-Aminobenzyl alcohol by a semi-sandwich ruthenium complex 2a is as follows: Synthesis of the semi-sandwich ruthenium complex with a 2,6-dithionone-substituted pyridine coordination compound 2a: At 25 °C, 0.05 mmol of [(CymeneRuCl2)2] and 0.1 mmol of 2,6-dimethylimidazolium-substituted pyridine were weighed into a Schlenk reaction tube, followed by the addition of 5 mL of DCM. The mixture was stirred for 16 hours under nitrogen protection. After the reaction was complete, the solution was filtered, the solvent was removed by rotary evaporation, 2 mL of CH3OH was added to dissolve the solid, and then an aqueous solution of saturated KPF6 (containing 0.25 mmol of KPF6) was added. A solid was immediately produced. The solid was washed with a small amount of water and diethyl ether to give 58 mg of a yellow-brown solid, with a yield of 71%.

In an air atmosphere, a polytetrafluoroethylene magnetic particle was placed in a reaction tube. 7.5 × 10⁻⁴ mmol of the semi-sandwich ruthenium coordination compound 2a was added, along with 0.3 mmol of 4-aldehyde nitrobenzene, 0.0375 ml of CH₃CN, 1.5 ml of water, 1.3 mmol of NH₃BH₃, and 0.021 mmol of CTAB. The mixture was stirred at 80 °C for 10 hours under vacuum. After the reaction was complete, the reaction solution was transferred to a separatory funnel and extracted three times with 1 ml of ethyl acetate each time. Gas chromatography-mass spectrometry (GC-MS) analysis yielded 4-Aminobenzyl alcohol (99.2% yield).
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi,Xn
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S37/39:Wear suitable gloves and eye/face protection .
[WGK Germany ]

3
[F ]

4.7-8-10-23
[Hazard Note ]

Irritant
[HS Code ]

29221990
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Ethanol-->Hydrochloric acid-->Iron-->Sodium dithionite-->4-Nitrobenzyl alcohol
[Preparation Products]

4-ACETAMIDOBENZYL CHLORIDE-->Fmoc-Val-Ala-PAB-OH-->4-ACETAMIDOBENZYL ALCOHOL-->CI 42500-->BOC-4-AMINOBENZYLALCOHOL-->MC-Val-Cit-PAB-->FMoc-Val-Cit-PAB
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

4-Hydroxymethylaniline(623-04-1).msds
Hazard InformationBack Directory
[Chemical Properties]

white to light yellow crystal powde
[Uses]

4-Aminobenzyl alcohol is used in the synthesis of 4-{N-[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)-3-methylbutylamino}benzyl ester. It is also used as an intermediate in organic synthesis and pharmaceutical products.
Spectrum DetailBack Directory
[Spectrum Detail]

4-Aminobenzyl alcohol(623-04-1)MS
4-Aminobenzyl alcohol(623-04-1)1HNMR
4-Aminobenzyl alcohol(623-04-1)IR1
4-Aminobenzyl alcohol(623-04-1)IR2
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

4-Aminobenzyl alcohol, 99%(623-04-1)
[Alfa Aesar]

4-Aminobenzyl alcohol, 98%(623-04-1)
[Sigma Aldrich]

623-04-1(sigmaaldrich)
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