3-Furancarbonitrile,2-bromo- supplier

Name
2-Bromofuran-3-carbonitrile
EINECS
CAS No. 921939-06-2
Density 1.8 g/cm³
Solubility
Melting Point 45.5-47
Formula C₅H₂BrNO
Boiling Point 242.9 °C at 760 mmHg
Molecular Weight 171.9795
Flash Point 100.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-bromofuran-3-carbonitrile;2-Bromo-3-furonitrile;
PSA 36.93000
LogP 1.91378

3-Furancarbonitrile,2-bromo- Specification

The 3-Furancarbonitrile,2-bromo-, with the CAS registry number 921939-06-2, has the systematic name of 2-bromofuran-3-carbonitrile. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C₅H₂BrNO.

The characteristics of 3-Furancarbonitrile,2-bromo- are as followings: (1)ACD/LogP: 1.56; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.56; (4)ACD/LogD (pH 7.4): 1.56 ; (5)#H bond acceptors: 2; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 0; (8)Polar Surface Area: 36.93 Å²; (9)Index of Refraction: 1.576; (10)Molar Refractivity: 31.52 cm³; (11)Molar Volume: 95.1 cm³; (12)Polarizability: 12.49×10^-24cm³; (13)Surface Tension: 55.1 dyne/cm; (14)Density: 1.8 g/cm³; (15)Flash Point: 100.7 °C; (16)Enthalpy of Vaporization: 47.99 kJ/mol; (17)Boiling Point: 242.9 °C at 760 mmHg; (18)Vapour Pressure: 0.0332 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: c1coc(c1C#N)Br
(2)InChI: InChI=1/C5H2BrNO/c6-5-4(3-7)1-2-8-5/h1-2H
(3)InChIKey: NVOHYBBWRRHLKB-UHFFFAOYAF

Product Name

2-Bromofuran-3-carbonitrile

3-Furancarbonitrile,2-bromo- Specification

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