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623-05-2

Basic Information
CAS No.: 623-05-2
Name: Benzenemethanol,4-hydroxy-
Molecular Structure:
Molecular Structure of 623-05-2 (Benzenemethanol,4-hydroxy-)
Formula: C7H8O2
Molecular Weight: 124.14
Synonyms: Benzylalcohol, p-hydroxy- (8CI);(4-Hydroxyphenyl)methanol;4-(Hydroxymethyl)phenol;4-Hydroxybenzenemethanol;4-Methylolphenol;Gastrodigenin;NSC 227926;p-(Hydroxymethyl)phenol;p-Hydroxybenzyl alcohol;p-Methoxytoluol;p-Methylolphenol;a-Hydroxy-p-cresol;
EINECS: 210-768-0
Density: 1.22 g/cm3
Melting Point: 110-112 °C
Boiling Point: 252 °C at 760 mmHg
Flash Point: 145.8 °C
Solubility: Soluble in water (6.7 mg/ml at 20°C), dioxane (100 mg/ml), 1N NaOH (50 mg/ml), DMSO, and methanol.
Appearance: Pink to beige crystalline powder
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-24/25-36
Transport Information:
PSA: 40.46000
LogP: 0.88450
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Specification

The 4-Hydroxybenzyl alcohol, with the CAS registry number 623-05-2, is also known as Benzenemethanol, 4-hydroxy-. It belongs to the product categories of Alcohols; C7 to C8; Linkers; Peptide Synthesis; Aromatics; Benzhydrols, Benzyl & Special Alcohols; Alphabetical Listings; Flavors and Fragrances; G-H; Bifunctional Crosslinkers Oxygen Compounds. Its EINECS registry number is 210-768-0. This chemical's molecular formula is C7H8O2 and molecular weight is 124.14. Its IUPAC name is called 4-(hydroxymethyl)phenol. The product should be sealed and stored in cool and dry place. What's more, it should be protected from strong oxides. It can be used as organic intermediates.

Physical properties of 4-Hydroxybenzyl alcohol: (1)ACD/LogP: 0.30; (2)ACD/LogD (pH 5.5): 0.3; (3)ACD/LogD (pH 7.4): 0.3; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 34.61; (7)ACD/KOC (pH 7.4): 34.45; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Index of Refraction: 1.595; (12)Molar Refractivity: 34.58 cm3; (13)Molar Volume: 101.6 cm3; (14)Surface Tension: 54.1 dyne/cm; (15)Density: 1.22 g/cm3; (16)Flash Point: 145.8 °C; (17)Enthalpy of Vaporization: 51.7 kJ/mol; (18)Boiling Point: 252 °C at 760 mmHg; (19)Vapour Pressure: 0.0104 mmHg at 25°C.

Preparation: this chemical can be prepared by 4-hydroxy-benzaldehyde. This reaction will need reagent Dowex1-x8, NaBH4 and solvent tetrahydrofuran. The reaction time is 30 min with reaction temperature of 20 °C. The yield is about 92%.

Uses of 4-Hydroxybenzyl alcohol: it can be used to produce 4-Methoxymethyl-phenol at temperature of 80 °C. This reaction will need reagent Yb(OTf)3 and solvent acetonitrile with reaction time of 5 hours. The yield is about 85%.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=CC=C1CO)O
(2)InChI: InChI=1S/C7H8O2/c8-5-6-1-3-7(9)4-2-6/h1-4,8-9H,5H2
(3)InChIKey: BVJSUAQZOZWCKN-UHFFFAOYSA-N

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