Benzyltriethylammonium Iodide

• Catalog Number: ACM5400942
• Product Name: Benzyltriethylammonium Iodide
• CAS: 5400-94-2
• Category: Heterocyclic Organic Compound
• Synonyms: EINECS 226-446-8; TRA0083276; TR-019090; NSC-10409; triethylbenzylammonium iodide; C13H22IN; CTK4J9303; MFCD00043178; BENZYLTRIETHYLAMMONIUMIODIDE; benzyl(triethyl)ammonium hydroiodide
• IUPAC Name: benzyl(triethyl)azanium;iodide
• Molecular Weight: 319.23g/mol
• Molecular Formula: C13H22IN
• Canonical SMILES: CC[N+](CC)(CC)CC1=CC=CC=C1.[I-]
• InChI: InChI=1S/C13H22N.HI/c1-4-14(5-2,6-3)12-13-10-8-7-9-11-13;/h7-11H,4-6,12H2,1-3H3;1H/q+1;/p-1
• InChI Key: JWLJBISFJGEYMT-UHFFFAOYSA-M
• Complexity: 135
• Covalently-Bonded Unit Count: 2
• EC Number: 226-446-8
• Exact Mass: 319.08g/mol
• H-Bond Acceptor: 1
• Heavy Atom Count: 15
• Monoisotopic Mass: 319.08g/mol
• NSC Number: 10409
• Rotatable Bond Count: 5
• Topological Polar Surface Area: 0A^2