CID 11235896

C19H44OSiSn — CID 11235896

IUPAC—
SMILESCCCC[Sn](CCCC)CCCC.CC[Si](CC)OC(C)C
InChIInChI=1S/C7H17OSi.3C4H9.Sn/c1-5-9(6-2)8-7(3)4;3*1-3-4-2;/h7H,5-6H2,1-4H3;3*1,3-4H2,2H3;
InChIKeyOEESFZSQDVCOHZ-UHFFFAOYSA-N
MW435.36 g/mol
LogP7.32
Rot. Bonds13

About CID 11235896

CID 11235896 (PubChem CID 11235896) has the molecular formula C19H44OSiSn and a molecular weight of 435.36 g/mol.

Molecular Properties

Compound NameCID 11235896
PubChem CID11235896
Molecular FormulaC19H44OSiSn
Molecular Weight435.36 g/mol
Exact Mass436.22
IUPAC Name—
SMILESCCCC[Sn](CCCC)CCCC.CC[Si](CC)OC(C)C
InChIInChI=1S/C7H17OSi.3C4H9.Sn/c1-5-9(6-2)8-7(3)4;3*1-3-4-2;/h7H,5-6H2,1-4H3;3*1,3-4H2,2H3;
InChIKeyOEESFZSQDVCOHZ-UHFFFAOYSA-N
XLogP7.32
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500435.36
LogP ≤ 57.32
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 11235896?
The IUPAC name of CID 11235896 (CID 11235896) is not available.
What is the SMILES notation for CID 11235896?
The canonical SMILES for CID 11235896 is CCCC[Sn](CCCC)CCCC.CC[Si](CC)OC(C)C.
What is the InChIKey of CID 11235896?
The InChIKey is OEESFZSQDVCOHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17OSi.3C4H9.Sn/c1-5-9(6-2)8-7(3)4;3*1-3-4-2;/h7H,5-6H2,1-4H3;3*1,3-4H2,2H3;.
What are the key properties of CID 11235896?
CID 11235896 has a molecular weight of 435.36 g/mol, XLogP of 7.32, 13 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 11235896 is sourced from PubChem (CID 11235896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).