CID 102208560

C28H45Si2 — CID 102208560

IUPAC—
SMILESCC(C)[Si](C#C[C]1C=C=CC(C#C[Si](C(C)C)(C(C)C)C(C)C)=C1)(C(C)C)C(C)C
InChIInChI=1S/C28H45Si2/c1-21(2)29(22(3)4,23(5)6)18-16-27-14-13-15-28(20-27)17-19-30(24(7)8,25(9)10)26(11)12/h14-15,20-26H,1-12H3
InChIKeyMUHHYLUZKASBSC-UHFFFAOYSA-N
MW437.84 g/mol
LogP8.65
Rot. Bonds6

About CID 102208560

CID 102208560 (PubChem CID 102208560) has the molecular formula C28H45Si2 and a molecular weight of 437.84 g/mol.

Molecular Properties

Compound NameCID 102208560
PubChem CID102208560
Molecular FormulaC28H45Si2
Molecular Weight437.84 g/mol
Exact Mass437.31
IUPAC Name—
SMILESCC(C)[Si](C#C[C]1C=C=CC(C#C[Si](C(C)C)(C(C)C)C(C)C)=C1)(C(C)C)C(C)C
InChIInChI=1S/C28H45Si2/c1-21(2)29(22(3)4,23(5)6)18-16-27-14-13-15-28(20-27)17-19-30(24(7)8,25(9)10)26(11)12/h14-15,20-26H,1-12H3
InChIKeyMUHHYLUZKASBSC-UHFFFAOYSA-N
XLogP8.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500437.84
LogP ≤ 58.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 102208560?
The IUPAC name of CID 102208560 (CID 102208560) is not available.
What is the SMILES notation for CID 102208560?
The canonical SMILES for CID 102208560 is CC(C)[Si](C#C[C]1C=C=CC(C#C[Si](C(C)C)(C(C)C)C(C)C)=C1)(C(C)C)C(C)C.
What is the InChIKey of CID 102208560?
The InChIKey is MUHHYLUZKASBSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H45Si2/c1-21(2)29(22(3)4,23(5)6)18-16-27-14-13-15-28(20-27)17-19-30(24(7)8,25(9)10)26(11)12/h14-15,20-26H,1-12H3.
What are the key properties of CID 102208560?
CID 102208560 has a molecular weight of 437.84 g/mol, XLogP of 8.65, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 102208560 is sourced from PubChem (CID 102208560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).