CID 66774119

C14H21OSi — CID 66774119

IUPAC—
SMILESCCCCc1ccccc1C(CCC)O[Si]
InChIInChI=1S/C14H21OSi/c1-3-5-9-12-10-6-7-11-13(12)14(15-16)8-4-2/h6-7,10-11,14H,3-5,8-9H2,1-2H3
InChIKeyDKNQQLDEUQYZGI-UHFFFAOYSA-N
MW233.41 g/mol
LogP3.97
Rot. Bonds7

About CID 66774119

CID 66774119 (PubChem CID 66774119) has the molecular formula C14H21OSi and a molecular weight of 233.41 g/mol.

Molecular Properties

Compound NameCID 66774119
PubChem CID66774119
Molecular FormulaC14H21OSi
Molecular Weight233.41 g/mol
Exact Mass233.14
IUPAC Name—
SMILESCCCCc1ccccc1C(CCC)O[Si]
InChIInChI=1S/C14H21OSi/c1-3-5-9-12-10-6-7-11-13(12)14(15-16)8-4-2/h6-7,10-11,14H,3-5,8-9H2,1-2H3
InChIKeyDKNQQLDEUQYZGI-UHFFFAOYSA-N
XLogP3.97
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.41
LogP ≤ 53.97
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 66774119?
The IUPAC name of CID 66774119 (CID 66774119) is not available.
What is the SMILES notation for CID 66774119?
The canonical SMILES for CID 66774119 is CCCCc1ccccc1C(CCC)O[Si].
What is the InChIKey of CID 66774119?
The InChIKey is DKNQQLDEUQYZGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21OSi/c1-3-5-9-12-10-6-7-11-13(12)14(15-16)8-4-2/h6-7,10-11,14H,3-5,8-9H2,1-2H3.
What are the key properties of CID 66774119?
CID 66774119 has a molecular weight of 233.41 g/mol, XLogP of 3.97, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 66774119 is sourced from PubChem (CID 66774119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).