-
Name
THIOPHENE, 2-(BROMOMETHYL)-
- EINECS
- CAS No. 45438-73-1
- Article Data51
- CAS DataBase
- Density 1.633 g/cm3
- Solubility
- Melting Point -10 °C
- Formula C5H5BrS
- Boiling Point 193.251 °C at 760 mmHg
- Molecular Weight 177.065
- Flash Point 70.676 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms 2-Thenyl bromide;2-Thienylmethyl bromide;
- PSA 28.24000
- LogP 2.64300
2-Bromomethylthiophene Specification
The 2-Bromomethylthiophene with the CAS number 45438-73-1 is also called Thiophene,2-(bromomethyl)-. Its molecular formula is C5H5BrS. This chemical is a kind of organics. It should be stored in dry and cool environment.
The properties of the chemical are: (1)ACD/LogP: 2.46; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 0; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 28.24Å2; (7)Index of Refraction: 1.604; (8)Molar Refractivity: 37.285 cm3; (9)Molar Volume: 108.405 cm3; (10)Polarizability: 14.781×10-24cm3; (11)Surface Tension: 44.117 dyne/cm; (12)Enthalpy of Vaporization: 41.188 kJ/mol; (13)Vapour Pressure: 0.654 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: BrCc1sccc1
(2)InChI: InChI=1/C5H5BrS/c6-4-5-2-1-3-7-5/h1-3H,4H2
(3)InChIKey: QZOBOLDDGXPTBP-UHFFFAOYAN
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