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Tris (3-fluorophenyl) phosphine

CAT: 0127-PC7886B-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0127-PC7886B-01Size:1 g
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CAS Number
23039-94-3
MDL Number
MFCD00015722
Purity
97%
Smiles
Fc1cccc(c1)P(c2cccc(F)c2)c3cccc(F)c3

Chemical Information

Tris(3-fluorophenyl)phosphine
CAS Number23039-94-3
PubChem CID140988
IUPAC Nametris(3-fluorophenyl)phosphane
Molecular FormulaC18H12F3P
Molecular Weight316.3
XLogP4.9
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count22
Formal Charge0
Complexity299
SMILES
C1=CC(=CC(=C1)P(C2=CC=CC(=C2)F)C3=CC=CC(=C3)F)F
InChI
InChI=1S/C18H12F3P/c19-13-4-1-7-16(10-13)22(17-8-2-5-14(20)11-17)18-9-3-6-15(21)12-18/h1-12H
InChIKey
CUTRINLXFPIWQB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Tris(3-fluorophenyl)phosphine
CAS: 23039-94-3
CID: 140988
Formula: C18H12F3P
MW: 316.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight316.3
XLogP34.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass316.06287187
Monoisotopic Mass316.06287187
Topological Polar Surface Area0 Ų
Heavy Atom Count22
Formal Charge0
Complexity299
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes