N4159

NCS-382 hydrate

solid, ≥98% (HPLC)

• Synonym(s): 5,7,8,9-Tetrahydro-5-hydroxy-6H-benzocyclohepten-6-ylidene acetic acid monosodium salt hydrate
• Empirical Formula (Hill Notation): C₁₃H₁₃O₃Na · xH₂O
• CAS Number: 1049743-38-5
• Molecular Weight: 240.23 (anhydrous basis)
• UNSPSC Code: 12352202
• PubChem Substance ID: 24278588
• MDL number: MFCD11046018
• Assay: ≥98% (HPLC)
• Form: solid

Properties

• Quality Segment: 100
• assay: ≥98% (HPLC)
• form: solid
• color: white to off-white
• solubility: H₂O: 22 mg/mL
• SMILES string: O.[Na+].OC1C(\CCCc2ccccc12)=C\C([O-])=O
• InChI: 1S/C13H14O3.Na.H2O/c14-12(15)8-10-6-3-5-9-4-1-2-7-11(9)13(10)16;;/h1-2,4,7-8,13,16H,3,5-6H2,(H,14,15);;1H2/q;+1;/p-1/b10-8+;;
• InChI key: FCHWTCFJPQOCCJ-PIHABLKOSA-M

Description

Biochem/physiol Actions

γ-Hydroxybutyrate (GHB) receptor antagonist; anti­convulsant.

Safety Information

• Storage Class: 11 - Combustible Solids
• wgk: WGK 3
• flash_point_f: Not applicable
• flash_point_c: Not applicable
• ppe: Eyeshields, Gloves, type N95 (US)