CID 10985617

C27H48P2PtSiTe — CID 10985617

IUPAC—
SMILESCCP(CC)CC.CCP(CC)CC.C[Si](C)C.[Pt].[Te]c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C12H9Te.2C6H15P.C3H9Si.Pt/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10;2*1-4-7(5-2)6-3;1-4(2)3;/h1-9H;2*4-6H2,1-3H3;1-3H3;
InChIKeyGFCFXGPJOJKGLW-UHFFFAOYSA-N
MW785.39 g/mol
LogP8.57
Rot. Bonds7

About CID 10985617

CID 10985617 (PubChem CID 10985617) has the molecular formula C27H48P2PtSiTe and a molecular weight of 785.39 g/mol.

Molecular Properties

Compound NameCID 10985617
PubChem CID10985617
Molecular FormulaC27H48P2PtSiTe
Molecular Weight785.39 g/mol
Exact Mass787.17
IUPAC Name—
SMILESCCP(CC)CC.CCP(CC)CC.C[Si](C)C.[Pt].[Te]c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C12H9Te.2C6H15P.C3H9Si.Pt/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10;2*1-4-7(5-2)6-3;1-4(2)3;/h1-9H;2*4-6H2,1-3H3;1-3H3;
InChIKeyGFCFXGPJOJKGLW-UHFFFAOYSA-N
XLogP8.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500785.39
LogP ≤ 58.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 10985617?
The IUPAC name of CID 10985617 (CID 10985617) is not available.
What is the SMILES notation for CID 10985617?
The canonical SMILES for CID 10985617 is CCP(CC)CC.CCP(CC)CC.C[Si](C)C.[Pt].[Te]c1ccc(-c2ccccc2)cc1.
What is the InChIKey of CID 10985617?
The InChIKey is GFCFXGPJOJKGLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9Te.2C6H15P.C3H9Si.Pt/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10;2*1-4-7(5-2)6-3;1-4(2)3;/h1-9H;2*4-6H2,1-3H3;1-3H3;.
What are the key properties of CID 10985617?
CID 10985617 has a molecular weight of 785.39 g/mol, XLogP of 8.57, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 10985617 is sourced from PubChem (CID 10985617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).