{[bis(propan-2-yl)amino](propoxy)phosphanyl}bis(propan-2-yl)amine

• ChemBase ID: 296510
• Molecular Formular: C15H35N2OP
• Molecular Mass: 290.424961
• Monoisotopic Mass: 290.24870038
• SMILES: CCCOP(N(C(C)C)C(C)C)N(C(C)C)C(C)C
• Canonical SMILES: CCCOP(N(C(C)C)C(C)C)N(C(C)C)C(C)C
• InChI: InChI=1S/C15H35N2OP/c1-10-11-18-19(16(12(2)3)13(4)5)17(14(6)7)15(8)9/h12-15H,10-11H2,1-9H3
• InChIKey: OTEPWYBGBKUVGE-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: {[bis(propan-2-yl)amino](propoxy)phosphanyl}bis(propan-2-yl)amine
• IUPAC Traditional name: [(diisopropylamino)(propoxy)phosphanyl]diisopropylamine
• Synonyms: n-Propyl N,N,N',N'-tetraisopropylphosphorodiamidite; N,N,N ',N '-四异丙基氨基亚磷酸正丙酯

Database IDs

• MDL Number: MFCD09953492
• PubChem SID: 180682041
• PubChem CID: 42553057

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): 2.6319473
• LogD (pH = 7.4): 2.6379063
• Log P: 3.9324
• Molar Refractivity: 87.6119 cm^3
• Polarizability: 34.833424 Å^3
• Polar Surface Area: 15.71 Å^2
• Rotatable Bonds: 9
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• European Hazard Symbols: Irritant (Xi)
• Risk Statements: 36/37/38
• Safety Statements: 26-37
• TSCA Listed: 否
• GHS Pictograms: GHS07
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305+P351+P338-P302+P352-P321-P405-P501A