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Basic Information
CAS No.: 37614-58-7
Name: 3-(4-BROMO-PHENYL)-PROP-2-YN-1-OL
Molecular Structure:
Molecular Structure of 37614-58-7 (3-(4-BROMO-PHENYL)-PROP-2-YN-1-OL)
Formula: C9H7BrO
Molecular Weight: 211.058
Synonyms: 1-(4-Bromophenyl)propyne-3-ol;3-(4-Bromophenyl)-2-propyn-1-ol;3-(p-Bromophenyl)propargyl alcohol;
Density: 1.58 g/cm3
Boiling Point: 304.2 °C at 760 mmHg
Flash Point: 137.8 °C
PSA: 20.23000
LogP: 1.79290
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Specification

The 2-Propyn-1-ol,3-(4-bromophenyl)- is an organic compound with the formula C9H7BrO. The systematic name of this chemical is 3-(3-bromophenyl)prop-2-yn-1-ol. With the CAS registry number 37614-58-7, it is also named as 3-(3-Bromo-phenyl)-prop-2-yn-1-ol.

Physical properties about 2-Propyn-1-ol,3-(4-bromophenyl)- are: (1)ACD/LogP: 3.10; (2)#H bond acceptors: 1; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 2; (5)Polar Surface Area: 9.23 Å2; (6)Index of Refraction: 1.638; (7)Molar Refractivity: 47.9 cm3; (8)Molar Volume: 133.2 cm3; (9)Polarizability: 18.99×10-24cm3; (10)Surface Tension: 58.9 dyne/cm; (11)Density: 1.58 g/cm3; (12)Flash Point: 137.8 °C; (13)Enthalpy of Vaporization: 57.5 kJ/mol; (14)Boiling Point: 304.2 °C at 760 mmHg; (15)Vapour Pressure: 0.000389 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1cc(C#CCO)ccc1
(2)InChI: InChI=1/C9H7BrO/c10-9-5-1-3-8(7-9)4-2-6-11/h1,3,5,7,11H,6H2
(3)InChIKey: UNSAJINGUOTTRA-UHFFFAOYAX