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2,1,3-Benzothiadiazole-4,7-diol

2,1,3-Benzothiadiazole-4,7-diol structure

CAS No:
35142-84-8
Formula:
C6H4N2O2S
Chemical Name:
2,1,3-Benzothiadiazole-4,7-diol
Synonyms:
2,1,3-Benzothiadiazole-4,7-diol;4,7-dihydroxybenzo<2,3-c><1,2,5>thiadiazole

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2,1,3-Benzothiadiazole-4,7-diol Basic Attributes

Molecular Weight：

168.17

Exact Mass：

167.99934855

DSSTox ID：

DTXSID00503061

Characteristics

Density：

1.745±0.06 g/cm3

Melting Point：

194-195 °C

Boiling Point：

400.4±25.0 °C(Predicted)

PKA：

7.44±0.40

Computed Properties

Molecular Weight:168.18
XLogP3:1.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Exact Mass:167.99934855
Monoisotopic Mass:167.99934855
Topological Polar Surface Area:94.5
Heavy Atom Count:11
Complexity:142
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,1,3-Benzothiadiazole-4,7-diol

Basic Attributes
Characteristics
Computed Properties

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