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(2-Chlorophenyl) diphenylphosphine

CAT: 0127-OR1058914-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1058914-01Size:100 mg
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CAS Number
35035-62-2
MDL Number
MFCD03284243
Purity
97%
Smiles
ClC1=CC=CC=C1P(C2=CC=CC=C2)C3=CC=CC=C3

Chemical Information

(2-Chlorophenyl)(diphenyl)phosphane
CAS Number35035-62-2
PubChem CID303889
IUPAC Name(2-chlorophenyl)-diphenylphosphane
Molecular FormulaC18H14ClP
Molecular Weight296.7
XLogP5.2
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count3
Heavy Atom Count20
Formal Charge0
Complexity263
SMILES
C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3Cl
InChI
InChI=1S/C18H14ClP/c19-17-13-7-8-14-18(17)20(15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14H
InChIKey
HGHHUFKKOXRZTH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (2-Chlorophenyl)(diphenyl)phosphane
CAS: 35035-62-2
CID: 303889
Formula: C18H14ClP
MW: 296.7
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight296.7
XLogP35.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count3
Exact Mass296.0521651
Monoisotopic Mass296.0521651
Topological Polar Surface Area0 Ų
Heavy Atom Count20
Formal Charge0
Complexity263
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