CID 164665693

C25H57Ge2KOSi6 — CID 164665693

IUPAC—
SMILESC[Si](C)C.C[Si](C)C.C[Si](C)[Si](C)C.C[Si](C)[Si](C)C.O=C([Ge])C12CC3CC(CC(C3)C1)C2.[Ge].[K]
InChIInChI=1S/C11H15GeO.2C4H12Si2.2C3H9Si.Ge.K/c12-10(13)11-4-7-1-8(5-11)3-9(2-7)6-11;2*1-5(2)6(3)4;2*1-4(2)3;;/h7-9H,1-6H2;2*1-4H3;2*1-3H3;;
InChIKeyOPOSECQGIZYMTP-UHFFFAOYSA-N
MW726.56 g/mol
LogP7.02
Rot. Bonds3

About CID 164665693

CID 164665693 (PubChem CID 164665693) has the molecular formula C25H57Ge2KOSi6 and a molecular weight of 726.56 g/mol.

Molecular Properties

Compound NameCID 164665693
PubChem CID164665693
Molecular FormulaC25H57Ge2KOSi6
Molecular Weight726.56 g/mol
Exact Mass728.11
IUPAC Name—
SMILESC[Si](C)C.C[Si](C)C.C[Si](C)[Si](C)C.C[Si](C)[Si](C)C.O=C([Ge])C12CC3CC(CC(C3)C1)C2.[Ge].[K]
InChIInChI=1S/C11H15GeO.2C4H12Si2.2C3H9Si.Ge.K/c12-10(13)11-4-7-1-8(5-11)3-9(2-7)6-11;2*1-5(2)6(3)4;2*1-4(2)3;;/h7-9H,1-6H2;2*1-4H3;2*1-3H3;;
InChIKeyOPOSECQGIZYMTP-UHFFFAOYSA-N
XLogP7.02
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms35
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500726.56
LogP ≤ 57.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 164665693?
The IUPAC name of CID 164665693 (CID 164665693) is not available.
What is the SMILES notation for CID 164665693?
The canonical SMILES for CID 164665693 is C[Si](C)C.C[Si](C)C.C[Si](C)[Si](C)C.C[Si](C)[Si](C)C.O=C([Ge])C12CC3CC(CC(C3)C1)C2.[Ge].[K].
What is the InChIKey of CID 164665693?
The InChIKey is OPOSECQGIZYMTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15GeO.2C4H12Si2.2C3H9Si.Ge.K/c12-10(13)11-4-7-1-8(5-11)3-9(2-7)6-11;2*1-5(2)6(3)4;2*1-4(2)3;;/h7-9H,1-6H2;2*1-4H3;2*1-3H3;;.
What are the key properties of CID 164665693?
CID 164665693 has a molecular weight of 726.56 g/mol, XLogP of 7.02, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 164665693 is sourced from PubChem (CID 164665693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).