2-Benzothiazolesulfenanilide structure

2-Benzothiazolesulfenanilide

N-(1,3-benzothiazol-2-ylsulfanyl)aniline

Also Known As: 2-Benzothiazolesulfenanilide|N-phenylbenzothiazole-2-sulfenamide|Benzenamine,n-(2-benzothiazolylthio)-|N-(1,3-benzothiazol-2-ylsulfanyl)aniline|N-[(1,3-Benzothiazol-2-yl)sulfanyl]aniline

CAS: 34844-45-6
Molecular Formula C13H10N2S2
Molecular Weight 258.02853 g/mol
LogP 4.7
Topological Polar Surface Area 78.5 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 3
Exact Mass 258.02853
Monoisotopic Mass 258.02853
Heavy Atoms 17
Complexity 244.0

Chemical Identifiers

CAS Number 34844-45-6
SMILES C1=CC=C(C=C1)NSC2=NC3=CC=CC=C3S2
InChIKey UQZVTALCNXYOKW-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.

Heterocyclic Building Blocks (1 patents) Organic Building Blocks (4 patents) Organometallic Reagents (1 patents) Polymer Intermediates (2 patents)

Product Overview

2-Benzothiazolesulfenanilide (CAS 34844-45-6), with molecular formula C13H10N2S2 and molecular weight 258.02853 g/mol. IUPAC: N-(1,3-benzothiazol-2-ylsulfanyl)aniline.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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