tris(prop-2-en-1-yl) phosphite

• ChemBase ID: 111431
• Molecular Formular: C9H15O3P
• Molecular Mass: 202.187361
• Monoisotopic Mass: 202.07588097
• SMILES: C=CCOP(OCC=C)OCC=C
• Canonical SMILES: C=CCOP(OCC=C)OCC=C
• InChI: InChI=1S/C9H15O3P/c1-4-7-10-13(11-8-5-2)12-9-6-3/h4-6H,1-3,7-9H2
• InChIKey: KJWHEZXBZQXVSA-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: tris(prop-2-en-1-yl) phosphite
• IUPAC Traditional name: tris(prop-2-en-1-yl) phosphite
• Synonyms: TRIALLYL PHOSPHITE; Triallyl phosphite; 亚磷酸三丙烯酯

Database IDs

• CAS Number: 102-84-1
• EC Number: 203-060-8
• MDL Number: MFCD00014948
• Beilstein Number: 1705535
• PubChem SID: 162103313
• PubChem CID: 66893

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): 3.1276982
• LogD (pH = 7.4): 3.1277
• Log P: 3.1277
• Molar Refractivity: 55.4648 cm^3
• Polarizability: 21.3867 Å^3
• Polar Surface Area: 27.69 Å^2
• Rotatable Bonds: 9
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Liquid
• Boiling Point: 84°C; 84°C/12mm
• Flash Point: 86°C(187°F)

Safety Information

• Storage Warning: Air & Moisture Sensitive
• RTECS: TH1772500
• European Hazard Symbols: Toxic (T)
• UN Number: UN3278
• Hazard Class: 6.1
• Packing Group: III
• Risk Statements: 21-25
• Safety Statements: 36/37-45
• TSCA Listed: 是
• GHS Pictograms: GHS06
• GHS Hazard statements: H301-H312
• GHS Precautionary statements: P280H-P309-P310