1,3-Benzothiazol-2(3H)-Ylidenemalononitrile
[CAS# 4464-52-2]

Identification

• Name: 1,3-Benzothiazol-2(3H)-Ylidenemalononitrile
• Synonyms: 2-(benzo[d]thiazol-2(3H)-ylidene)malononitrile; propanedinitrile, 2(3H)-benzothiazolylidene-
• Molecular Formula: C₁₀H₅N₃S
• Molecular Weight: 199.23
• CAS Registry Number: 4464-52-2
• SMILES: N#C/C(C#N)=C2/Sc1ccccc1N2
• InChI: 1S/C10H5N3S/c11-5-7(6-12)10-13-8-3-1-2-4-9(8)14-10/h1-4,13H
• InChIKey: VUNPYDYMOWBARG-UHFFFAOYSA-N

Properties

• Density: 1.396g/cm³ (Cal.)
• Boiling point: 290.096°C at 760 mmHg (Cal.)
• Flash point: 129.246°C (Cal.)