phenyldipropylphosphane

• ChemBase ID: 107496
• Molecular Formular: C12H19P
• Molecular Mass: 194.253021
• Monoisotopic Mass: 194.12243724
• SMILES: CCCP(CCC)c1ccccc1
• Canonical SMILES: CCCP(c1ccccc1)CCC
• InChI: InChI=1S/C12H19P/c1-3-10-13(11-4-2)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3
• InChIKey: OSRKWUXYLYWDOH-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: phenyldipropylphosphane
• IUPAC Traditional name: phenyldipropylphosphane
• Synonyms: DI-n-PROPYLPHENYLPHOSPHINE

Database IDs

• CAS Number: 7650-83-1
• PubChem SID: 162094828
• PubChem CID: 292611

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 3.2267127
• LogD (pH = 7.4): 3.7605696
• Log P: 3.7954
• Molar Refractivity: 60.4161 cm^3
• Polarizability: 24.150932 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 5
• Lipinski's Rule of Five: true

DETAILS

MP Biomedicals - 05203980

MP Biomedicals Rare Chemical collection