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Home > Encyclopedia > 2-(METHYLSULFONYL)BENZOTHIAZOLE,97

2-(METHYLSULFONYL)BENZOTHIAZOLE,97

2-(METHYLSULFONYL)BENZOTHIAZOLE,97 structure

2-(METHYLSULFONYL)BENZOTHIAZOLE,97 

structure
  • CAS No:

    7144-49-2

  • Formula:

    C8H7NO2S2

  • Chemical Name:

    2-(METHYLSULFONYL)BENZOTHIAZOLE,97

  • Synonyms:

    NSC 51671;Methyl 2-benzothiazolyl sulfone;2-(methylsulfonyl)benzothiazole;2-(METHYLSULFONYL)BENZOTHIAZOLE, 97;Benzothiazole, 2-(methylsulfonyl)- (6CI,8CI,9CI)

  • Categories:

    Active Pharmaceutical Ingredients  >  Other Chemical Drugs

2-(METHYLSULFONYL)BENZOTHIAZOLE,97 Basic Attributes

213.27700

212.99200

51671

DTXSID10287587

2934200090

Characteristics

83.65000

2.78060

1.44g/cm3

86-89ºC(lit.)

370.3ºC at 760 mmHg

177.7ºC

1.645

Safety Information

36/37/38

26-36

Xi

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

H315

|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|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

methylsulfonyl benzothiazole

Computed Properties

Molecular Weight:213.3
XLogP3:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:212.99182081
Monoisotopic Mass:212.99182081
Topological Polar Surface Area:83.6
Heavy Atom Count:13
Complexity:283
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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