Name: Name:1H-Benzo[d][1,2,3]triazole-4-sulfonic acid
Brand: Angene
SKU: AG003O2W
Rating: 90 (10 reviews)

1H-Benzo[d][1,2,3]triazole-4-sulfonic acid

CAS No.:

26725-50-8

Catalog Number:

AG003O2W

Molecular Formula:

C6H5N3O3S

Molecular Weight:

199.1872

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Product Description

Catalog Number:

AG003O2W

Chemical Name:

1H-Benzo[d][1,2,3]triazole-4-sulfonic acid

CAS Number:

26725-50-8

Molecular Formula:

C6H5N3O3S

Molecular Weight:

199.1872

MDL Number:

MFCD03452776

IUPAC Name:

2H-benzotriazole-4-sulfonic acid

InChI:

InChI=1S/C6H5N3O3S/c10-13(11,12)5-3-1-2-4-6(5)8-9-7-4/h1-3H,(H,7,8,9)(H,10,11,12)

InChI Key:

WVKWKEWFTVEVCF-UHFFFAOYSA-N

SMILES:

OS(=O)(=O)c1cccc2c1nn[nH]2

EC Number:

305-552-9

Properties

Complexity:

286

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

199.005g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

199.184g/mol

Monoisotopic Mass:

199.005g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

104A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.2

Literature

Title	Journal
Bis(1H-benzotriazole-7-sulfonato-κO)bis-(1,10-phenanthroline-κN,N')cadmium dihydrate.	Acta crystallographica. Section E, Structure reports online 20111201
Bis(1H-benzotriazole-4-sulfonato-κN,O)(2,2'-bipyridyl-κN,N')cadmium.	Acta crystallographica. Section E, Structure reports online 20111201
catena-Poly[[(1,10-phenanthroline-κN,N')zinc]-μ-4-sulfonato-benzo-triazolido-κN,O:N].	Acta crystallographica. Section E, Structure reports online 20111201

Properties