2-[bis(propan-2-yl)amino]ethyl ethyl methylphosphonite

• ChemBase ID: 129205
• Molecular Formular: C11H26NO2P
• Molecular Mass: 235.303401
• Monoisotopic Mass: 235.17011571
• SMILES: CCOP(C)OCCN(C(C)C)C(C)C
• Canonical SMILES: CCOP(OCCN(C(C)C)C(C)C)C
• InChI: InChI=1S/C11H26NO2P/c1-7-13-15(6)14-9-8-12(10(2)3)11(4)5/h10-11H,7-9H2,1-6H3
• InChIKey: OIQVKKOBTVZIFE-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-[bis(propan-2-yl)amino]ethyl ethyl methylphosphonite
• IUPAC Traditional name: QL (chemical)
• Synonyms: Isopropyl aminoethylmethyl phosphonite; O-(2-diisopropylaminoethyl) O'-ethyl methylphosphonite; QL (chemical)

Database IDs

• PubChem SID: 162223502
• PubChem CID: 170325
• Wikipedia Title: QL_(chemical)

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): -1.4863254
• LogD (pH = 7.4): -0.2811303
• Log P: 2.2429
• Molar Refractivity: 66.342 cm^3
• Polarizability: 26.619217 Å^3
• Polar Surface Area: 21.7 Å^2
• Rotatable Bonds: 8
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Safety Statements: R