Ethanone,2-bromo-1-(5-bromo-2-thienyl)- supplier

Name
2-BROMO-1-(5-BROMOTHIOPHEN-2-YL)ETHANONE
EINECS
CAS No. 10531-44-9
Article Data27
CAS DataBase
Density 2.031 g/cm³
Solubility
Melting Point 92-93 °C
Formula C₆H₄Br₂OS
Boiling Point 329.1 °C at 760 mmHg
Molecular Weight 283.971
Flash Point 152.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Ketone,bromomethyl 5-bromo-2-thienyl (7CI,8CI);2-Bromo-1-(5-bromo-2-thienyl)ethanone;2-Bromo-5-(bromoacetyl)thiophene;Bromomethyl 5-bromo-2-thienyl ketone;
PSA 45.31000
LogP 3.08820

Ethanone,2-bromo-1-(5-bromo-2-thienyl)- Specification

The Ethanone,2-bromo-1-(5-bromo-2-thienyl)- is an organic compound with the formula C₆H₄Br₂OS. The IUPAC name of this chemical is 2-bromo-1-(5-bromothiophen-2-yl)ethanone. With the CAS registry number 10531-44-9, it is also named as 2-Bromo-1-(5-bromo-2-thienyl)ethanone. In addition, the molecular weight is 283.97.

The other characteristics of Ethanone,2-bromo-1-(5-bromo-2-thienyl)- can be summarized as: (1)ACD/LogP: 2.77; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 45.31 Å²; (7)Index of Refraction: 1.635; (8)Molar Refractivity: 50.08 cm³; (9)Molar Volume: 139.8 cm³; (10)Polarizability: 19.85×10^-24 cm³; (11)Surface Tension: 53.5 dyne/cm; (12)Enthalpy of Vaporization: 57.15 kJ/mol; (13)Vapour Pressure: 0.000182 mmHg at 25°C; (14)Rotatable Bond Count: 2; (15)Tautomer Count: 2; (16)Exact Mass: 283.832914; (17)MonoIsotopic Mass: 281.834961; (18)Topological Polar Surface Area: 45.3; (19)Heavy Atom Count: 10; (20)Complexity: 140.

People can use the following data to convert to the molecule structure.
1. SMILES:O=C(c1sc(Br)cc1)CBr
2. InChI:InChI=1/C6H4Br2OS/c7-3-4(9)5-1-2-6(8)10-5/h1-2H,3H2
3. InChIKey:OZBXRAVUJGCRFN-UHFFFAOYAS
4. Std. InChI:InChI=1S/C6H4Br2OS/c7-3-4(9)5-1-2-6(8)10-5/h1-2H,3H2
5. Std. InChIKey:OZBXRAVUJGCRFN-UHFFFAOYSA-N

Product Name

2-BROMO-1-(5-BROMOTHIOPHEN-2-YL)ETHANONE

Ethanone,2-bromo-1-(5-bromo-2-thienyl)- Specification

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