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Home > Encyclopedia > 1,2-Benzisoxazole-3-carboxylic acid

1,2-Benzisoxazole-3-carboxylic acid

1,2-Benzisoxazole-3-carboxylic acid structure

1,2-Benzisoxazole-3-carboxylic acid 

structure
  • CAS No:

    28691-47-6

  • Formula:

    C8H5NO3

  • Chemical Name:

    1,2-Benzisoxazole-3-carboxylic acid

  • Synonyms:

    1,2-Benzisoxazole-3-carboxylic acid;3-Carboxy-1,2-benzisoxazole;Benzo[d]isoxazole-3-carboxylic acid;3-Benzo[d]isoxazolecarboxylic acid;1,2-Benzoxazole-3-carboxylic acid

  • Categories:

    Chemical Reagents  >  Organic Reagents

1,2-Benzisoxazole-3-carboxylic acid Basic Attributes

163.13

163.13

DTXSID70370727

2934999090

Characteristics

63.3

1.6

1.5±0.1 g/cm3

145-146 °C

379.7°C at 760 mmHg

183.5±20.4 °C

1.661

0mmHg at 25°C

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:163.13
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:163.026943022
Monoisotopic Mass:163.026943022
Topological Polar Surface Area:63.3
Heavy Atom Count:12
Complexity:195
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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