Clonidine 4-isothiocyanate

N-(2,6-dichloro-4-isothiocyanatophenyl)-4,5-dihydro-1H-imidazol-2-amine

CAS: 81913-29-3

Molecular Formula	`C10H8Cl2N4S`
Molecular Weight	287.17 g/mol
LogP	3.4
Topological Polar Surface Area	80.9 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	3
Rotatable Bonds	3
Exact Mass	285.98468
Heavy Atoms	17
Complexity	344.0

Chemical Identifiers

CAS Number	81913-29-3
SMILES	`C1CN=C(N1)NC2=C(C=C(C=C2Cl)N=C=S)Cl`
InChIKey	`KLZSOMBZDISYIO-UHFFFAOYSA-N`

📖 Product Overview

Clonidine 4-isothiocyanate (CAS: 81913-29-3) is a chemical compound with molecular formula C10H8Cl2N4S and molecular weight 287.17 g/mol. Its IUPAC systematic name is N-(2,6-dichloro-4-isothiocyanatophenyl)-4,5-dihydro-1H-imidazol-2-amine. LogP 3.4 Topological Polar Surface Area 80.9 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 3 Rotatable Bonds 3 Exact Mass 285.98468 Heavy Atoms 17 Complexity 344.0 InChI Key: KLZSOMBZDISYIO-UHFFFAOYSA-N. SMILES: C1CN=C(N1)NC2=C(C=C(C=C2Cl)N=C=S)Cl.

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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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