2-Naphthylthioacetonitrile structure

2-Naphthylthioacetonitrile

2-naphthalen-2-ylsulfanylacetonitrile

Also Known As: 2-Naphthylthioacetonitrile|2-(2-naphthylthio)acetonitrile|2-naphthalen-2-ylsulfanylacetonitrile|Maybridge1_004490|2-(Naphthalen-2-ylthio)acetonitrile|2-Naphthalenylthioacetonitrile|(2-Naphthylsulfanyl)acetonitrile|2-(2-naphthylthio)ethanenitrile|HMS554E02|2-(naphthalen-2-ylsulfanyl)acetonitrile|Acetonitrile,2-(2-naphthalenylthio)-|(2-Naphthylsulfanyl)acetonitrile #|2-(2-naphthylsulfanyl)acetonitrile|Acetonitrile, 2-(2-naphthalenylthio)-|3-(PHENYLAMINO)PROPANOIC ACID|[(Naphthalen-2-yl)sulfanyl]acetonitrile|SR-01000637056-1

CAS: 574-77-6
Molecular Formula C12H9NS
Molecular Weight 199.04558 g/mol
LogP 3.8
Topological Polar Surface Area 49.1 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
Rotatable Bonds 2
Exact Mass 199.04558
Monoisotopic Mass 199.04558
Heavy Atoms 14
Complexity 230.0

Chemical Identifiers

CAS Number 574-77-6
SMILES C1=CC=C2C=C(C=CC2=C1)SCC#N
InChIKey PFMHSJMACRLMEX-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.

Heterocyclic Building Blocks (2 patents) Pharmaceutical Intermediates (2 patents)

Product Overview

2-Naphthylthioacetonitrile (CAS 574-77-6), with molecular formula C12H9NS and molecular weight 199.04558 g/mol. IUPAC: 2-naphthalen-2-ylsulfanylacetonitrile.

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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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