Metaphit

Base Information

• Chemical Name: Metaphit
• CAS No.: 96316-00-6
• Molecular Formula: C18H24 N2 S
• Molecular Weight: 300.4616
• UNII: NFS3HJC8WD
• DSSTox Substance ID: DTXSID00914572
• Nikkaji Number: J134.039E
• Wikipedia: Metaphit
• Wikidata: Q6553528
• Pharos Ligand ID: FUMW2Q2PTLG5
• ChEMBL ID: CHEMBL41541
• Mol file: 96316-00-6.mol

Synonyms:1-(1-(3-isothiocyanatophenyl)cyclohexyl)piperidine;metaphit

Chemical Property of Metaphit

Chemical Property:

• Vapor Pressure: 1.01E-07mmHg at 25°C
• Boiling Point: 433.7°Cat760mmHg
• Flash Point: 216.1°C
• PSA: 110.44000
• Density: 1.12g/cm³
• LogP: 5.58890
• Storage Temp.: −20°C
• Solubility.: H2O: soluble
• XLogP3: 5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 300.16601995
• Heavy Atom Count: 21
• Complexity: 377

Purity/Quality:

98%Min ^*data from raw suppliers

Metaphit ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1CCC(CC1)(C2=CC(=CC=C2)N=C=S)N3CCCCC3
• Uses: An irreversible, non-competitive antagonist at the PCP site on the NMDA receptor, and an irreversible, competitive antagonist at sigma receptors

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