CAS No.5330-38-1,5-CHLORO-2-HYDROXYBENZYL ALCOHOL Suppliers

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Basic Information

Molecular Structure:
CAS No.:	5330-38-1
Name:	5-CHLORO-2-HYDROXYBENZYL ALCOHOL
Article Data:	35

Formula:	C₇H₇ClO₂
Molecular Weight:	158.584
Synonyms:	Benzylalcohol, 5-chloro-2-hydroxy- (7CI,8CI);Saligenin, 5-chloro- (6CI);4-Chloro-2-(hydroxymethyl)phenol;5-Chloro-2-hydroxybenzyl alcohol;5-Chlorosalicyl alcohol;5-Chlorosaligenin;NSC 2468;
EINECS:	226-225-6
Density:	1.395g/cm³
Melting Point:	90 °C
Boiling Point:	258.2 °C at 760 mmHg
Flash Point:	110 °C
Risk Codes:	36/37/38
Safety:	26-36/37/39
PSA:	40.46000
LogP:	1.53790

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Specification

The Benzenemethanol,5-chloro-2-hydroxy-, with CAS registry number 5330-38-1, belongs to the following product categories: (1)Benzhydrols, Benzyl & Special Alcohols; (2)Aromatic alcohols and diols. It has the systematic name of 4-chloro-2-(hydroxymethyl)phenol. And the chemical formula of this chemical is C₇H₇ClO₂. What's more, its EINECS is 226-225-6.

Physical properties of Benzenemethanol,5-chloro-2-hydroxy-: (1)ACD/LogP: 1.24; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.24; (4)ACD/LogD (pH 7.4): 1.24; (5)ACD/BCF (pH 5.5): 5.18; (6)ACD/BCF (pH 7.4): 5.14; (7)ACD/KOC (pH 5.5): 112.89; (8)ACD/KOC (pH 7.4): 112.09; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 18.46 Å²; (13)Index of Refraction: 1.611; (14)Molar Refractivity: 39.48 cm³; (15)Molar Volume: 113.6 cm³; (16)Polarizability: 15.65×10^-24cm³; (17)Surface Tension: 56.6 dyne/cm; (18)Density: 1.395 g/cm³; (19)Flash Point: 110 °C; (20)Enthalpy of Vaporization: 51.58 kJ/mol; (21)Boiling Point: 258.2 °C at 760 mmHg; (22)Vapour Pressure: 0.00862 mmHg at 25°C.

Preparation: this chemical can be prepared by 5-chloro-2-hydroxy-benzoic acid. This reaction will need reagents LiAlH₄, diethyl ether.

Uses of Benzenemethanol,5-chloro-2-hydroxy-: it can be used to produce 2,6-dichloro-4H-benzo[1,3,2]dioxaphosφnine. This reaction will need reagents PCl₃, pyridine and solvent diethyl ether. The reaction time is 2 hour(s) with reaction temperature of -10 ℃.

When you are using this chemical, please be cautious about it as the following:
The Benzenemethanol,5-chloro-2-hydroxy- irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc(c(O)cc1)CO
(2)InChI: InChI=1/C7H7ClO2/c8-6-1-2-7(10)5(3-6)4-9/h1-3,9-10H,4H2
(3)InChIKey: AFPSETMCMFRVPG-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C7H7ClO2/c8-6-1-2-7(10)5(3-6)4-9/h1-3,9-10H,4H2
(5)Std. InChIKey: AFPSETMCMFRVPG-UHFFFAOYSA-N