[(2-Isothiocyanatoethyl)sulfanyl]benzene structure

[(2-Isothiocyanatoethyl)sulfanyl]benzene

2-isothiocyanatoethylsulfanylbenzene

Also Known As: [(2-isothiocyanatoethyl)thio]benzene|[(2-isothiocyanatoethyl)sulfanyl]benzene|2-isothiocyanatoethylsulfanylbenzene|(2-ISOTHIOCYANATOETHYL)THIO]BENZENE|(2-isothiocyanatoethyl)(phenyl)sulfane|Benzene,[(2-isothiocyanatoethyl)thio]-|((2-isothiocyanatoethyl)sulfanyl)benzene|Isothiocyanicacid,2-(phenylthio)ethyl ester|835-686-8

CAS: 38752-37-3
Molecular Formula C9H9NS2
Molecular Weight 195.01764 g/mol
LogP 2.8815
Topological Polar Surface Area 12.36 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
Rotatable Bonds 4
Exact Mass 195.01764
Monoisotopic Mass 195.01764
Heavy Atoms 12
Complexity 265.11685

Chemical Identifiers

CAS Number 38752-37-3
SMILES C1=CC=C(C=C1)SCCN=C=S

Product Overview

[(2-Isothiocyanatoethyl)sulfanyl]benzene (CAS 38752-37-3), with molecular formula C9H9NS2 and molecular weight 195.01764 g/mol. IUPAC: 2-isothiocyanatoethylsulfanylbenzene.

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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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