CID 162352840

C21H39Si — CID 162352840

IUPAC—
SMILESCCCCCC[Si](CCCCCC)C1C(C)=C(C)C(C)=C1C
InChIInChI=1S/C21H39Si/c1-7-9-11-13-15-22(16-14-12-10-8-2)21-19(5)17(3)18(4)20(21)6/h21H,7-16H2,1-6H3
InChIKeyDOCKUGVNWPFMEG-UHFFFAOYSA-N
MW319.63 g/mol
LogP7.70
Rot. Bonds11

About CID 162352840

CID 162352840 (PubChem CID 162352840) has the molecular formula C21H39Si and a molecular weight of 319.63 g/mol.

Molecular Properties

Compound NameCID 162352840
PubChem CID162352840
Molecular FormulaC21H39Si
Molecular Weight319.63 g/mol
Exact Mass319.28
IUPAC Name—
SMILESCCCCCC[Si](CCCCCC)C1C(C)=C(C)C(C)=C1C
InChIInChI=1S/C21H39Si/c1-7-9-11-13-15-22(16-14-12-10-8-2)21-19(5)17(3)18(4)20(21)6/h21H,7-16H2,1-6H3
InChIKeyDOCKUGVNWPFMEG-UHFFFAOYSA-N
XLogP7.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds11
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500319.63
LogP ≤ 57.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 162352840?
The IUPAC name of CID 162352840 (CID 162352840) is not available.
What is the SMILES notation for CID 162352840?
The canonical SMILES for CID 162352840 is CCCCCC[Si](CCCCCC)C1C(C)=C(C)C(C)=C1C.
What is the InChIKey of CID 162352840?
The InChIKey is DOCKUGVNWPFMEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H39Si/c1-7-9-11-13-15-22(16-14-12-10-8-2)21-19(5)17(3)18(4)20(21)6/h21H,7-16H2,1-6H3.
What are the key properties of CID 162352840?
CID 162352840 has a molecular weight of 319.63 g/mol, XLogP of 7.70, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 162352840 is sourced from PubChem (CID 162352840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).