Base information

Cat. No.
CAS No.849924-40-9
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C38H47FeO2P2
Molecular Weight 653.571
Exact Mass 653.24
XLogP3 9.0248
Mr 187.929
PSA 45.64
Sequence -
Atom number 90
Bond number 101
Ring number 12
Rotor number 9
Residues number 0
Canonical smiles COc1c(C)cc(cc1C)P([CH-]12[CH]3=[CH]4[Fe+2]5678923([C]1(=C45)[C@@H](P(C(C)(C)C)C(C)(C)C)C)[c-]1c6c8c9c71)c1cc(C)c(c(c1)C)OC

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