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DPPF

CAT: 0013-GTR19244814-01Size: 25 gDry Ice: NoHazardous: No
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CAT#:0013-GTR19244814-01Size:25 g
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Description
DPPF (1,1'-Ferrocenediyl-bis (diphenylphosphine) ) is a biochemical reagent utilized as a biomaterial or an organic compound in life science research.
CAS Number
12150-46-8
Smiles
C=1C=CC (=CC1) P (C=2C=CC=CC2) [C-]34[CH]5=[CH]6[CH]7=[CH]3[Fe+2]6789%10%1154[CH]=%12[CH]%11=[CH]%10[C-]9 (P (C=%13C=CC=CC%13) C=%14C=CC=CC%14) [CH]%128
Molecular Formula
C34H28FeP2
Molecular Weight
554.38
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

1,1-Bis(diphenylphosphino)ferrocene

an ionophore; structure in first source

CAS Number12150-46-8
PubChem CID15182658
IUPAC Namebis(cyclopenta-1,4-dien-1-yl(diphenyl)phosphane);iron(2+)
Molecular FormulaC34H28FeP2
Molecular Weight554.4
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Heavy Atom Count37
Formal Charge0
Complexity214
SMILES
[CH-]1C=CC(=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[CH-]1C=CC(=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Fe+2]
InChI
InChI=1S/2C17H14P.Fe/c2*1-3-9-15(10-4-1)18(17-13-7-8-14-17)16-11-5-2-6-12-16;/h2*1-14H;/q2*-1;+2
InChIKey
KZPYGQFFRCFCPP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,1-Bis(diphenylphosphino)ferrocene
CAS: 12150-46-8
CID: 15182658
Formula: C34H28FeP2
MW: 554.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight554.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Exact Mass554.101560
Monoisotopic Mass554.101560
Topological Polar Surface Area0 Ų
Heavy Atom Count37
Formal Charge0
Complexity214
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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