2-Propyn-1-ol,3-(3-bromophenyl)- supplier

Name
3-(3-BROMOPHENYL)PROP-2-YN-1-OL
EINECS
CAS No. 170859-80-0
Article Data12
CAS DataBase
Density 1.58g/cm³
Solubility
Melting Point
Formula C₉H₇BrO
Boiling Point 304.2 °C at 760 mmHg
Molecular Weight 211.058
Flash Point 137.8 °C
Transport Information
Appearance
Safety
Risk Codes Xi:Irritant;
Molecular Structure
Hazard Symbols Xi
Synonyms 3-(3-Bromophenyl)-2-propyn-1-ol;
PSA 20.23000
LogP 1.79290

2-Propyn-1-ol,3-(3-bromophenyl)- Specification

The 2-Propyn-1-ol,3-(3-bromophenyl)-, with CAS registry number 170859-80-0, has the systematic name of 3-(3-bromophenyl)prop-2-yn-1-ol. Besides this, it is also called 3-(3-Bromophenyl)-2-propyn-1-ol. And the chemical formula of this chemical is C₉H₇BrO.

Physical properties of 2-Propyn-1-ol,3-(3-bromophenyl)-: (1)ACD/LogP: 3.10; (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: 1.638; (8)Molar Refractivity: 47.9 cm³; (9)Molar Volume: 133.2 cm³; (10)Polarizability: 18.99×10^-24cm³; (11)Surface Tension: 58.9 dyne/cm; (12)Density: 1.58 g/cm³; (13)Flash Point: 137.8 °C; (14)Enthalpy of Vaporization: 57.5 kJ/mol; (15)Boiling Point: 304.2 °C at 760 mmHg; (16)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

Product Name

3-(3-BROMOPHENYL)PROP-2-YN-1-OL

2-Propyn-1-ol,3-(3-bromophenyl)- Specification

Related Products

Hot Products