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Home > Encyclopedia > 4-BROMO-1-METHYL-1H-PYRAZOLE-5-CARBALDEHYDE

4-BROMO-1-METHYL-1H-PYRAZOLE-5-CARBALDEHYDE

4-BROMO-1-METHYL-1H-PYRAZOLE-5-CARBALDEHYDE structure

4-BROMO-1-METHYL-1H-PYRAZOLE-5-CARBALDEHYDE 

structure
  • CAS No:

    473528-88-0

  • Formula:

    C5H5BrN2O

  • Chemical Name:

    4-BROMO-1-METHYL-1H-PYRAZOLE-5-CARBALDEHYDE

  • Synonyms:

    AKOS B007395;4-BROMO-1-METHYLPYRAZOLE-5-CARBOXALDEHYDE;4-BROMO-1-METHYL-1H-PYRAZOLE-5-CARBALDEHYDE;4-BROMO-2-METHYL-2 H-PYRAZOLE-3-CARBALDEHYDE;ART-CHEM-BB B007395;4-Bromo-1-methylpyrazole-5-carbaldehyde;4-Bromo-2-methylpyrazole-3-carbaldehyde;4-BroMo-1-Methyl-1H-pyrazole-5-carboxaldehyde, 97%

4-BROMO-1-METHYL-1H-PYRAZOLE-5-CARBALDEHYDE Basic Attributes

189.01

187.95900

DTXSID50383279

2933199090

Characteristics

34.9

0.7

1.73 g/cm3

102-103°C

275.2°C at 760 mmHg

120.2ºC

Safety Information

36/37/38

26-36/37/39

Xi:Irritant;

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

H315

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

4-BROMO-1-METHYL-1H-PYRAZOLE-5-CARBALDEHYDE Use and Manufacturing

To a solution of 1 -methyl- lH-pyrazole-5-carbaldehyde (1.0 g, 9.09 mmol) in DMF (8 mL) was slowly added NBS (1.62 g, 9.09 mmol) in DMF (5 mL). The mixture was stirred for overnight at room temperature. 1 N NaOH (9.1 mL) was added and the solution was stirred for 10 min, diluted with water (100 mL), extracted with EtOAc (30 mL* 3), dried over MgS0

Computed Properties

Molecular Weight:189.01
XLogP3:0.7
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:187.95853
Monoisotopic Mass:187.95853
Topological Polar Surface Area:34.9
Heavy Atom Count:9
Complexity:120
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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