CID 68659666

C14H14OSi — CID 68659666

IUPAC—
SMILESCc1cc(-c2ccccc2)cc(C)c1[Si]O
InChIInChI=1S/C14H14OSi/c1-10-8-13(9-11(2)14(10)16-15)12-6-4-3-5-7-12/h3-9,15H,1-2H3
InChIKeyPDYGRVQFAGNOPT-UHFFFAOYSA-N
MW226.35 g/mol
LogP2.21
Rot. Bonds2

About CID 68659666

CID 68659666 (PubChem CID 68659666) has the molecular formula C14H14OSi and a molecular weight of 226.35 g/mol.

Molecular Properties

Compound NameCID 68659666
PubChem CID68659666
Molecular FormulaC14H14OSi
Molecular Weight226.35 g/mol
Exact Mass226.08
IUPAC Name—
SMILESCc1cc(-c2ccccc2)cc(C)c1[Si]O
InChIInChI=1S/C14H14OSi/c1-10-8-13(9-11(2)14(10)16-15)12-6-4-3-5-7-12/h3-9,15H,1-2H3
InChIKeyPDYGRVQFAGNOPT-UHFFFAOYSA-N
XLogP2.21
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.35
LogP ≤ 52.21
H-Bond Donors ≤ 51
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 68659666?
The IUPAC name of CID 68659666 (CID 68659666) is not available.
What is the SMILES notation for CID 68659666?
The canonical SMILES for CID 68659666 is Cc1cc(-c2ccccc2)cc(C)c1[Si]O.
What is the InChIKey of CID 68659666?
The InChIKey is PDYGRVQFAGNOPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14OSi/c1-10-8-13(9-11(2)14(10)16-15)12-6-4-3-5-7-12/h3-9,15H,1-2H3.
What are the key properties of CID 68659666?
CID 68659666 has a molecular weight of 226.35 g/mol, XLogP of 2.21, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 68659666 is sourced from PubChem (CID 68659666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).