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Home > Encyclopedia > 2,1,3-BENZOTHIADIAZOL-4-YLBORONIC ACID

2,1,3-BENZOTHIADIAZOL-4-YLBORONIC ACID

2,1,3-BENZOTHIADIAZOL-4-YLBORONIC ACID structure

2,1,3-BENZOTHIADIAZOL-4-YLBORONIC ACID 

structure
  • CAS No:

    499769-94-7

  • Formula:

    C6H5BN2O2S

  • Chemical Name:

    2,1,3-BENZOTHIADIAZOL-4-YLBORONIC ACID

  • Synonyms:

    Benzo-2,1,3-thiadiazole-4-boronic acid;2,1,3-BENZOTHIADIAZOL-4-YLBORONIC ACID;BENZO[C][1,2,5]THIADIAZOL-4-YLBORONIC ACID;Benzo[c][1,2,5]thiadiazole-4-boronic acid;ACMC-1AJVH;C6H5BN2O2S;CTK4J1849;DTXSID90674976;ANW-30882;AKOS006292179

2,1,3-BENZOTHIADIAZOL-4-YLBORONIC ACID Basic Attributes

179.99

180.01600

DTXSID90674976

Characteristics

94.5

1.53 g/cm3

166.3ºC

383.1ºC at 760 mmHg

185.5ºC

Safety Information

R36/37/38

S26-S37/39

Xi:Irritant;

|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.

Computed Properties

Molecular Weight:180.00
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:180.0164787
Monoisotopic Mass:180.0164787
Topological Polar Surface Area:94.5
Heavy Atom Count:12
Complexity:172
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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