CID 164687048

C18H54ClSi8Sn- — CID 164687048

IUPAC—
SMILESC[Si](C)(C)[Si]([Si](C)(C)C)[Si](C)(C)C.C[Si](C)(C)[Si]([Si](C)(C)C)[Si](C)(C)C.Cl[Sn-]
InChIInChI=1S/2C9H27Si4.ClH.Sn/c2*1-11(2,3)10(12(4,5)6)13(7,8)9;;/h2*1-9H3;1H;/p-1
InChIKeyZUWQBFJTCKPENS-UHFFFAOYSA-M
MW649.48 g/mol
LogP7.77
Rot. Bonds6

About CID 164687048

CID 164687048 (PubChem CID 164687048) has the molecular formula C18H54ClSi8Sn- and a molecular weight of 649.48 g/mol.

Molecular Properties

Compound NameCID 164687048
PubChem CID164687048
Molecular FormulaC18H54ClSi8Sn-
Molecular Weight649.48 g/mol
Exact Mass649.11
IUPAC Name—
SMILESC[Si](C)(C)[Si]([Si](C)(C)C)[Si](C)(C)C.C[Si](C)(C)[Si]([Si](C)(C)C)[Si](C)(C)C.Cl[Sn-]
InChIInChI=1S/2C9H27Si4.ClH.Sn/c2*1-11(2,3)10(12(4,5)6)13(7,8)9;;/h2*1-9H3;1H;/p-1
InChIKeyZUWQBFJTCKPENS-UHFFFAOYSA-M
XLogP7.77
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500649.48
LogP ≤ 57.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 164687048?
The IUPAC name of CID 164687048 (CID 164687048) is not available.
What is the SMILES notation for CID 164687048?
The canonical SMILES for CID 164687048 is C[Si](C)(C)[Si]([Si](C)(C)C)[Si](C)(C)C.C[Si](C)(C)[Si]([Si](C)(C)C)[Si](C)(C)C.Cl[Sn-].
What is the InChIKey of CID 164687048?
The InChIKey is ZUWQBFJTCKPENS-UHFFFAOYSA-M. The full InChI is InChI=1S/2C9H27Si4.ClH.Sn/c2*1-11(2,3)10(12(4,5)6)13(7,8)9;;/h2*1-9H3;1H;/p-1.
What are the key properties of CID 164687048?
CID 164687048 has a molecular weight of 649.48 g/mol, XLogP of 7.77, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 164687048 is sourced from PubChem (CID 164687048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).