1H-Imidazole-2-carboxaldehyde,5-bromo-1-methyl- supplier

Name
5-BROMO-1-METHYL-1H-IMIDAZOLE-2-CARBALDEHYDE
EINECS
CAS No. 79326-88-8
Density 1.73 g/cm³
Solubility
Melting Point 78-80 °C
Formula C₅H₅BrN₂O
Boiling Point 317 °C at 760 mmHg
Molecular Weight 189.011
Flash Point 145.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 5-Bromo-1-methyl-1H-imidazole-2-carboxaldehyde;
PSA 34.89000
LogP 0.99510

1H-Imidazole-2-carboxaldehyde,5-bromo-1-methyl- Specification

The 1H-Imidazole-2-carboxaldehyde,5-bromo-1-methyl- is an organic compound with the formula C₅H₅BrN₂O. The systematic name of this chemical is 5-bromo-1-methyl-imidazole-2-carbaldehyde. With the CAS registry number 79326-88-8, it is also named as 5-Bromo-2-formyl-1-methyl-1H-imidazole. The product's categories are Blocks; Bromides; Imidazoles.

Physical properties about 1H-Imidazole-2-carboxaldehyde,5-bromo-1-methyl- are: (1)ACD/LogP: 0.56; (2)ACD/LogD (pH 5.5): 0.56; (3)ACD/LogD (pH 7.4): 0.56; (4)#H bond acceptors: 3; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 34.89 Å²; (7)Index of Refraction: 1.621; (8)Molar Refractivity: 38.26 cm³; (9)Molar Volume: 108.7 cm³; (10)Polarizability: 15.17×10^-24cm³; (11)Surface Tension: 49.3 dyne/cm; (12)Density: 1.73 g/cm³; (13)Flash Point: 145.5 °C; (14)Enthalpy of Vaporization: 55.84 kJ/mol; (15)Boiling Point: 317 °C at 760 mmHg; (16)Vapour Pressure: 0.000396 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1cnc(C=O)n1C
(2)InChI: InChI=1/C5H5BrN2O/c1-8-4(6)2-7-5(8)3-9/h2-3H,1H3
(3)InChIKey: ZFUTWKQTEYLBKA-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C5H5BrN2O/c1-8-4(6)2-7-5(8)3-9/h2-3H,1H3
(5)Std. InChIKey: ZFUTWKQTEYLBKA-UHFFFAOYSA-N

Product Name

5-BROMO-1-METHYL-1H-IMIDAZOLE-2-CARBALDEHYDE

1H-Imidazole-2-carboxaldehyde,5-bromo-1-methyl- Specification

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