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Home > Encyclopedia > methyl4-bromo-1-methyl-1H-pyrazole-5-carboxylate

methyl4-bromo-1-methyl-1H-pyrazole-5-carboxylate

methyl4-bromo-1-methyl-1H-pyrazole-5-carboxylate structure

methyl4-bromo-1-methyl-1H-pyrazole-5-carboxylate 

structure
  • CAS No:

    514816-42-3

  • Formula:

    C6H7BrN2O2

  • Chemical Name:

    methyl4-bromo-1-methyl-1H-pyrazole-5-carboxylate

  • Synonyms:

    methyl 4-bromo-1-methyl-1H-pyrazole-5-carboxylate;1H-pyrazole-5-carboxylic acid, 4-bromo-1-methyl-, methyl ester;1H-pyrazole-5-carboxylic acid, 4-bromo-1-methyl-, methyl e;methyl 4-bromo-1-methyl-1H-pyrazole-5-carboxylate(SALTDATA: FREE);4-bromo-2-methyl-3-pyrazolecarboxylic acid methyl ester;4-bromo-2-methyl-pyrazole-3-carboxylic acid methyl ester;methyl 4-bromo-2-methyl-pyrazole-3-carboxylate;methyl 4-bromo-2-methylpyrazole-3-carboxylate

methyl4-bromo-1-methyl-1H-pyrazole-5-carboxylate Basic Attributes

219.04

217.96909 g/mol

DTXSID50350087

2933199090

Characteristics

44.12000

0.96920

1.67±0.1 g/cm3

276.5±20.0 °C(Predicted)

121ºC

1.589

-1.57±0.10

Safety Information

IRRITANT

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, 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.

Computed Properties

Molecular Weight:219.04
XLogP3:1.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:217.96909
Monoisotopic Mass:217.96909
Topological Polar Surface Area:44.1
Heavy Atom Count:11
Complexity:165
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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