Synonyms
Propylenebis(Diphenylphosphine)
IUPAC Name
3-diphenylphosphanylpropyl(diphenyl)phosphane
Molecular Weight
412.45
Molecular Formula
C27H26P2
Canonical SMILES
C1=CC=C(C=C1)P(CCCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4;
InChI
LVEYOSJUKRVCCF-UHFFFAOYSA-N
InChI Key
InChI=1S/C27H26P2/c1-5-14-24(15-6-1)28(25-16-7-2-8-17-25)22-13-23-29(26-18-9-3-10-19-26)27-20-11-4-12-21-27/h1-12,14-21H,13,22-23H2
Boiling Point
529.7±33.0 °C(Predicted)
Melting Point
63-65 °C(lit.)
Flash Point
235 °C
Purity
98%
Appearance
Solid
Storage
Store below +30°C.
Complexity
350
Covalently-Bonded Unit Count
1
EC Number
229-791-2
Exact Mass
412.151g/mol
Heavy Atom Count
29
Isomeric SMILES
C1=CC=C(C=C1)P(CCCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4
Monoisotopic Mass
412.151g/mol
NSC Number
193753
Rotatable Bond Count
8
Topological Polar Surface Area
0A^2
UNII
44R56E2C68
