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Home > Encyclopedia > Benzothiazole, 6-isothiocyanato-2-methoxy- (9CI)

Benzothiazole, 6-isothiocyanato-2-methoxy- (9CI)

Benzothiazole, 6-isothiocyanato-2-methoxy- (9CI) structure

Benzothiazole, 6-isothiocyanato-2-methoxy- (9CI) 

structure
  • CAS No:

    42517-38-4

  • Formula:

    C9H6N2OS2

  • Chemical Name:

    Benzothiazole, 6-isothiocyanato-2-methoxy- (9CI)

  • Synonyms:

    6-isothiocyanato-2-methoxy-1,3-benzothiazole;SCHEMBL11791846;ZINC45237695

Benzothiazole, 6-isothiocyanato-2-methoxy- (9CI) Basic Attributes

222.28674

221.992

Characteristics

94.8

4.1

Computed Properties

Molecular Weight:222.3
XLogP3:4.1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:221.99215517
Monoisotopic Mass:221.99215517
Topological Polar Surface Area:94.8
Heavy Atom Count:14
Complexity:255
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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