[3-(chloromagnesio)propyl]dimethylamine

• ChemBase ID: 804466
• Molecular Formular: C5H12ClMgN
• Molecular Mass: 145.91348
• Monoisotopic Mass: 145.05086877
• SMILES: [Mg](CCCN(C)C)Cl
• Canonical SMILES: Cl[Mg]CCCN(C)C
• InChI: InChI=1S/C5H12N.ClH.Mg/c1-4-5-6(2)3;;/h1,4-5H2,2-3H3;1H;/q;;+1/p-1
• InChIKey: NDYLAABPGFMVIY-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: [3-(chloromagnesio)propyl]dimethylamine
• IUPAC Traditional name: [3-(chloromagnesio)propyl]dimethylamine
• Synonyms: CHLORO[3-(DIMETHYLAMINO)PROPYL]MAGNESIUM

Database IDs

• CAS Number: 19070-16-7

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): -3.1588252
• LogD (pH = 7.4): -1.5165305
• Log P: 0.3116
• Molar Refractivity: 34.7731 cm^3
• Polarizability: 15.300217 Å^3
• Polar Surface Area: 3.24 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 98%