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Home > Encyclopedia > 6-BROMOBENZO[D]ISOXAZOLE-3-CARBOXYLIC ACID

6-BROMOBENZO[D]ISOXAZOLE-3-CARBOXYLIC ACID

6-BROMOBENZO[D]ISOXAZOLE-3-CARBOXYLIC ACID structure

6-BROMOBENZO[D]ISOXAZOLE-3-CARBOXYLIC ACID 

structure
  • CAS No:

    1123169-17-4

  • Formula:

    C8H4BrNO3

  • Chemical Name:

    6-BROMOBENZO[D]ISOXAZOLE-3-CARBOXYLIC ACID

  • Synonyms:

    6-Bromobenzo[d]isoxazole-3-carboxylic acid;6-Bromo-benzo[d]isoxazole-3-carboxylic acid;6-Bromo-1,2-benzoxazole-3-carboxylic acid;SCHEMBL19900067;CTK8C2819;DTXSID90670751;2162AA;ANW-69051;MFCD09027541;ZINC36075381

  • Categories:

    Chemical Reagents  >  Organic Reagents

6-BROMOBENZO[D]ISOXAZOLE-3-CARBOXYLIC ACID Basic Attributes

242.02626

240.93700

DTXSID90670751

2934999090

Characteristics

63.3

2.3

1.886±0.06 g/cm3(Predicted)

434.0±25.0 °C(Predicted)

Safety Information

22

Xn

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, P501

H302

|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:242.03
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:240.93746
Monoisotopic Mass:240.93746
Topological Polar Surface Area:63.3
Heavy Atom Count:13
Complexity:223
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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