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Home > Encyclopedia > 5-BroMoisothiazole-3-carboxylic acid

5-BroMoisothiazole-3-carboxylic acid

5-BroMoisothiazole-3-carboxylic acid structure

5-BroMoisothiazole-3-carboxylic acid 

structure
  • CAS No:

    4576-89-0

  • Formula:

    C4H2BrNO2S

  • Chemical Name:

    5-BroMoisothiazole-3-carboxylic acid

  • Synonyms:

    5-bromo-isothiazole-3-carboxylic acid;SCHEMBL1636617;5-bromo-1,2-thiazole-3-carboxylic acid

5-BroMoisothiazole-3-carboxylic acid Basic Attributes

208.03318

206.899

Characteristics

78.4

1.9

2.062±0.06 g/cm3(Predicted)

Safety Information

|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:208.04
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:206.89896
Monoisotopic Mass:206.89896
Topological Polar Surface Area:78.4
Heavy Atom Count:9
Complexity:132
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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