5-Bromo-2-(hydroxymethyl)phenol supplier

Name
5-BROMO-2-(HYDROXYMETHYL)PHENOL
EINECS
CAS No. 170434-11-4
Article Data6
CAS DataBase
Density 1.723 g/cm³
Solubility
Melting Point
Formula C₇H₇BrO₂
Boiling Point 327.936 °C at 760 mmHg
Molecular Weight 203.035
Flash Point 152.131 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Bromo-2-hydroxybenzylalcohol;
PSA 40.46000
LogP 1.64700

5-Bromo-2-(hydroxymethyl)phenol Specification

The Benzenemethanol, 4-bromo-2-hydroxy-, with CAS registry number 170434-11-4, has the systematic name of 5-bromo-2-(hydroxymethyl)phenol. Besides this, it is also called 4-Bromo-2-hydroxybenzylalcohol. And the chemical formula of this chemical is C₇H₇BrO₂.

Physical properties of Benzenemethanol, 4-bromo-2-hydroxy-: (1)ACD/LogP: 1.45; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.45; (4)ACD/LogD (pH 7.4): 1.44; (5)ACD/BCF (pH 5.5): 7.4; (6)ACD/BCF (pH 7.4): 7.23; (7)ACD/KOC (pH 5.5): 145.77; (8)ACD/KOC (pH 7.4): 142.42; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 40.46 Å²; (13)Index of Refraction: 1.636; (14)Molar Refractivity: 42.27 cm³; (15)Molar Volume: 117.8 cm³; (16)Polarizability: 16.75×10^-24cm³; (17)Surface Tension: 58.7 dyne/cm; (18)Density: 1.722 g/cm³; (19)Flash Point: 152.1 °C; (20)Enthalpy of Vaporization: 60.2 kJ/mol; (21)Boiling Point: 327.9 °C at 760 mmHg; (22)Vapour Pressure: 7.91E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: OCc1ccc(Br)cc1O
(2)InChI: InChI=1/C7H7BrO2/c8-6-2-1-5(4-9)7(10)3-6/h1-3,9-10H,4H2
(3)InChIKey: CHVJSQNPFPRTPB-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C7H7BrO2/c8-6-2-1-5(4-9)7(10)3-6/h1-3,9-10H,4H2
(5)Std. InChIKey: CHVJSQNPFPRTPB-UHFFFAOYSA-N

Product Name

5-BROMO-2-(HYDROXYMETHYL)PHENOL

5-Bromo-2-(hydroxymethyl)phenol Specification

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