[(2R)-1-(diphenylphosphanyl)propan-2-yl]diphenylphosphane

• ChemBase ID: 108170
• Molecular Formular: C27H26P2
• Molecular Mass: 412.442862
• Monoisotopic Mass: 412.15097409
• SMILES: C[C@H](CP(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1
• Canonical SMILES: C[C@@H](P(c1ccccc1)c1ccccc1)CP(c1ccccc1)c1ccccc1
• InChI: InChI=1S/C27H26P2/c1-23(29(26-18-10-4-11-19-26)27-20-12-5-13-21-27)22-28(24-14-6-2-7-15-24)25-16-8-3-9-17-25/h2-21,23H,22H2,1H3/t23-/m1/s1
• InChIKey: WGOBPPNNYVSJTE-HSZRJFAPSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: [(2R)-1-(diphenylphosphanyl)propan-2-yl]diphenylphosphane
• IUPAC Traditional name: [(2R)-1-(diphenylphosphanyl)propan-2-yl]diphenylphosphane
• Synonyms: BIS(1,2-DIPHENYLPHOSPHINO)PROPANE; (R)-PROPHOS; (R)-(+)-1,2-Bis(diphenylphosphino)propane; (R)-(+)-1,2-双(二苯基膦)丙烷; (R)-(+)-1,1'-(二苯基膦基)丙烷

Database IDs

• CAS Number: 67884-32-6
• MDL Number: MFCD00012309
• PubChem SID: 162094054; 24855687
• PubChem CID: 2724539

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 7.1907
• LogD (pH = 7.4): 7.1907
• Log P: 7.1907
• Molar Refractivity: 126.2238 cm^3
• Polarizability: 50.21126 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 7
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Melting Point: 71-73 °C(lit.); 71-73°C
• Optical Rotation: [α]20/D +184°, c = 1 in acetone

Safety Information

• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 36/37/38
• Safety Statements: 26-37; 26-37/39
• TSCA Listed: 否
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305 + P351 + P338; P261-P305+P351+P338-P302+P352-P321-P405-P501A
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves

Product Information

• Purity: 98%
• Linear Formula: (C6H5)2PCH(CH3)CH2P(C6H5)2

DETAILS

MP Biomedicals - 05206326

MP Biomedicals Rare Chemical collection

Sigma Aldrich - 259128

Packaging
1 g in glass bottle
250, 500 mg in glass bottle