propanedinitrile, 2(3H)-benzothiazolylidene- structure

propanedinitrile, 2(3H)-benzothiazolylidene-

2-(3H-1,3-benzothiazol-2-ylidene)propanedinitrile

Also Known As: 2-dicyanomethylene-benzothiazole|1,3-benzothiazol-2(3H)-ylidenemalononitrile|Benzothiazole-2(3H)-ylidenemalononitrile|propanedinitrile, 2(3H)-benzothiazolylidene-|2-(Benzo[d]thiazol-2(3H)-ylidene)malononitrile|2-(benzothiazol-2(3H)-ylidene)malononitrile|2-[benzothiazol-2(3H)-ylidene]malononitrile|J1.181.775K|1,3 - Benzthiazo - 2(3H)- ylidene Malononitrile|2-(3H-1,3-benzothiazol-2-ylidene)propanedinitrile|Propanedinitrile, 2(3H)-benzothiazolylidene- (9CI)|2-(2,3-dihydro-1,3-benzothiazol-2-ylidene)propanedinitrile

CAS: 4464-52-2
Molecular Formula C10H5N3S
Molecular Weight 199.02042 g/mol
LogP 2.0
Topological Polar Surface Area 84.9 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 0
Exact Mass 199.02042
Monoisotopic Mass 199.02042
Heavy Atoms 14
Complexity 349.0

Chemical Identifiers

CAS Number 4464-52-2
SMILES C1=CC=C2C(=C1)NC(=C(C#N)C#N)S2
InChIKey VUNPYDYMOWBARG-UHFFFAOYSA-N

Product Overview

propanedinitrile, 2(3H)-benzothiazolylidene- (CAS 4464-52-2), with molecular formula C10H5N3S and molecular weight 199.02042 g/mol. IUPAC: 2-(3H-1,3-benzothiazol-2-ylidene)propanedinitrile.

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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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propanedinitrile, 2(3H)-benzothiazolylidene- is a custom synthesis product. We offer services from milligram to kilogram scale.

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