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(R)-4-Bromo-alpha-methylbenzyl alcohol

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Name

(R)-4-Bromo-alpha-methylbenzyl alcohol

EINECS N/A
CAS No. 76155-78-7 Density 1.47 g/cm3
PSA 20.23000 LogP 2.50240
Solubility N/A Melting Point N/A
Formula C8H9BrO Boiling Point 253.3 °C at 760 mmHg
Molecular Weight 201.063 Flash Point 63.3 °C
Transport Information N/A Appearance clear colorless to light yellow liquid
Safety 36/37/39-26 Risk Codes 36/37/38-20/21/22
Molecular Structure Molecular Structure of 76155-78-7 ((R)-4-Bromo-alpha-methylbenzyl alcohol) Hazard Symbols HarmfulXn
Synonyms

Benzenemethanol,4-bromo-a-methyl-, (R)-;(+)-1-(4-Bromophenyl)ethanol;(+)-1-(p-Bromophenyl)ethanol;(R)-1-(4-Bromophenyl)ethanol;(R)-1-p-Bromophenylethanol;(aR)-4-Bromo-a-Methylbenzenemethanol;

Article Data 413

(R)-4-Bromo-alpha-methylbenzyl alcohol Specification

The systematic name of (R)-4-Bromo-alpha-methylbenzyl alcohol is (1R)-1-(4-bromophenyl)ethanol. With the CAS registry number 76155-78-7, it is also named as benzenemethanol, 4-bromo-a-methyl-, (aR)-. The product's categories are Alcohols, Hydroxy Esters and Derivatives; Chiral Compounds; API Intermediates. It is clear colorless to light yellow liquid which should be sealed in the container and stored in the cool and dry place.

The other characteristics of (R)-4-Bromo-alpha-methylbenzyl alcohol can be summarized as: (1)ACD/LogP: 2.15; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 9.23 Å2; (7)Index of Refraction: 1.572; (8)Molar Refractivity: 45.03 cm3; (9)Molar Volume: 136.6 cm3; (10)Polarizability: 17.85×10-24 cm3; (11)Surface Tension: 42.8 dyne/cm; (12)Density: 1.47 g/cm3; (13)Flash Point: 63.3 °C; (14)Enthalpy of Vaporization: 51.85 kJ/mol; (15)Boiling Point: 253.3 °C at 760 mmHg; (16)Vapour Pressure: 0.00956 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is not only harmful by inhalation, in contact with skin and if swallowed, but also irritating to eyes, respiratory system and skin. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. If you want to contact this product, you must wear suitable protective clothing, gloves and eye/face protection.

People can use the following data to convert to the molecule structure.
1. SMILES:Brc1ccc(cc1)[C@H](O)C
2. InChI:InChI=1/C8H9BrO/c1-6(10)7-2-4-8(9)5-3-7/h2-6,10H,1H3/t6-/m1/s1
3. InChIKey:XTDTYSBVMBQIBT-ZCFIWIBFBF

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