1-Cyano-4-methylnaphthalene structure

1-Cyano-4-methylnaphthalene

4-methylnaphthalene-1-carbonitrile

Also Known As: 1-Cyano-4-methylnaphthalene|4-Methyl-1-naphthonitrile|4-methylnaphthalene-1-carbonitrile|4-methylnaphthonitrile|1-Naphthalenecarbonitrile,4-methyl-|4-(1-Adamantyl)phenol|4-methyl-1-cyanonaphthalene|4-Methyl-1-naphthonitrile #|4-methyl-1-naphthalenecarbonitrile|1601AE|AB3975|J1.478.622H|Z-0073|2-Methoxy-4-(trifluoromethyl)pyridine-5-carboxamide|I14-26384|1-Cyano-4-methylnaphthalene, 4-Methyl-1-naphthonitrile, MolPort-000-153-712, ZINC02571855, CID142047, AKD-1109-283, 36062-93-8

CAS: 175204-87-2
Molecular Formula C12H9N
Molecular Weight 167.0735 g/mol
LogP 3.3
Topological Polar Surface Area 23.8 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 1
Rotatable Bonds 0
Exact Mass 167.0735
Monoisotopic Mass 167.0735
Heavy Atoms 13
Complexity 225.0

Chemical Identifiers

CAS Number 175204-87-2
SMILES CC1=CC=C(C2=CC=CC=C12)C#N
InChIKey XDIWTJZAYBYKHM-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.

Heterocyclic Building Blocks (45 patents) Organic Building Blocks (10 patents) Pharmaceutical Intermediates (59 patents)

Product Overview

1-Cyano-4-methylnaphthalene (CAS 175204-87-2), with molecular formula C12H9N and molecular weight 167.0735 g/mol. IUPAC: 4-methylnaphthalene-1-carbonitrile.

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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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