CID 66989831

C15H21OSi — CID 66989831

IUPAC—
SMILESCC(C)(O[Si])c1ccccc1C1CCCCC1
InChIInChI=1S/C15H21OSi/c1-15(2,16-17)14-11-7-6-10-13(14)12-8-4-3-5-9-12/h6-7,10-12H,3-5,8-9H2,1-2H3
InChIKeySMIUIMFPKGXEQP-UHFFFAOYSA-N
MW245.42 g/mol
LogP4.07
Rot. Bonds3

About CID 66989831

CID 66989831 (PubChem CID 66989831) has the molecular formula C15H21OSi and a molecular weight of 245.42 g/mol.

Molecular Properties

Compound NameCID 66989831
PubChem CID66989831
Molecular FormulaC15H21OSi
Molecular Weight245.42 g/mol
Exact Mass245.14
IUPAC Name—
SMILESCC(C)(O[Si])c1ccccc1C1CCCCC1
InChIInChI=1S/C15H21OSi/c1-15(2,16-17)14-11-7-6-10-13(14)12-8-4-3-5-9-12/h6-7,10-12H,3-5,8-9H2,1-2H3
InChIKeySMIUIMFPKGXEQP-UHFFFAOYSA-N
XLogP4.07
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.42
LogP ≤ 54.07
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 66989831?
The IUPAC name of CID 66989831 (CID 66989831) is not available.
What is the SMILES notation for CID 66989831?
The canonical SMILES for CID 66989831 is CC(C)(O[Si])c1ccccc1C1CCCCC1.
What is the InChIKey of CID 66989831?
The InChIKey is SMIUIMFPKGXEQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21OSi/c1-15(2,16-17)14-11-7-6-10-13(14)12-8-4-3-5-9-12/h6-7,10-12H,3-5,8-9H2,1-2H3.
What are the key properties of CID 66989831?
CID 66989831 has a molecular weight of 245.42 g/mol, XLogP of 4.07, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 66989831 is sourced from PubChem (CID 66989831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).