palladium;trans-(1S,2R)-1-propan-2-yl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-ol

C17H36O2PdSi — CID 134848093

IUPACpalladium;trans-(1S,2R)-1-propan-2-yl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-ol
SMILESCC(C)[C@@]1(O)C[C@H]1CCO[Si](C(C)C)(C(C)C)C(C)C.[Pd]
InChIInChI=1S/C17H36O2Si.Pd/c1-12(2)17(18)11-16(17)9-10-19-20(13(3)4,14(5)6)15(7)8;/h12-16,18H,9-11H2,1-8H3;/t16-,17+;/m1./s1
InChIKeyJVLWGEPHRXMERJ-PPPUBMIESA-N
MW406.98 g/mol
LogP4.97
Rot. Bonds8

About palladium;trans-(1S,2R)-1-propan-2-yl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-ol

palladium;trans-(1S,2R)-1-propan-2-yl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-ol (PubChem CID 134848093) has the molecular formula C17H36O2PdSi and a molecular weight of 406.98 g/mol. Its IUPAC name is palladium;trans-(1S,2R)-1-propan-2-yl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-ol.

Molecular Properties

Compound Namepalladium;trans-(1S,2R)-1-propan-2-yl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-ol
PubChem CID134848093
Molecular FormulaC17H36O2PdSi
Molecular Weight406.98 g/mol
Exact Mass406.15
IUPAC Namepalladium;trans-(1S,2R)-1-propan-2-yl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-ol
SMILESCC(C)[C@@]1(O)C[C@H]1CCO[Si](C(C)C)(C(C)C)C(C)C.[Pd]
InChIInChI=1S/C17H36O2Si.Pd/c1-12(2)17(18)11-16(17)9-10-19-20(13(3)4,14(5)6)15(7)8;/h12-16,18H,9-11H2,1-8H3;/t16-,17+;/m1./s1
InChIKeyJVLWGEPHRXMERJ-PPPUBMIESA-N
XLogP4.97
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.98
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze palladium;trans-(1S,2R)-1-propan-2-yl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of palladium;trans-(1S,2R)-1-propan-2-yl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-ol?
The IUPAC name of palladium;trans-(1S,2R)-1-propan-2-yl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-ol (CID 134848093) is palladium;trans-(1S,2R)-1-propan-2-yl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-ol.
What is the SMILES notation for palladium;trans-(1S,2R)-1-propan-2-yl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-ol?
The canonical SMILES for palladium;trans-(1S,2R)-1-propan-2-yl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-ol is CC(C)[C@@]1(O)C[C@H]1CCO[Si](C(C)C)(C(C)C)C(C)C.[Pd].
What is the InChIKey of palladium;trans-(1S,2R)-1-propan-2-yl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-ol?
The InChIKey is JVLWGEPHRXMERJ-PPPUBMIESA-N. The full InChI is InChI=1S/C17H36O2Si.Pd/c1-12(2)17(18)11-16(17)9-10-19-20(13(3)4,14(5)6)15(7)8;/h12-16,18H,9-11H2,1-8H3;/t16-,17+;/m1./s1.
What are the key properties of palladium;trans-(1S,2R)-1-propan-2-yl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-ol?
palladium;trans-(1S,2R)-1-propan-2-yl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-ol has a molecular weight of 406.98 g/mol, XLogP of 4.97, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for palladium;trans-(1S,2R)-1-propan-2-yl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-ol is sourced from PubChem (CID 134848093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).