CID 175501209

C16H23O3Si — CID 175501209

IUPAC—
SMILESCCCCCCCc1ccccc1C(CO)C(=O)O[Si]
InChIInChI=1S/C16H23O3Si/c1-2-3-4-5-6-9-13-10-7-8-11-14(13)15(12-17)16(18)19-20/h7-8,10-11,15,17H,2-6,9,12H2,1H3
InChIKeyKNSIWXBTFDNPNW-UHFFFAOYSA-N
MW291.44 g/mol
LogP2.90
Rot. Bonds9

About CID 175501209

CID 175501209 (PubChem CID 175501209) has the molecular formula C16H23O3Si and a molecular weight of 291.44 g/mol.

Molecular Properties

Compound NameCID 175501209
PubChem CID175501209
Molecular FormulaC16H23O3Si
Molecular Weight291.44 g/mol
Exact Mass291.14
IUPAC Name—
SMILESCCCCCCCc1ccccc1C(CO)C(=O)O[Si]
InChIInChI=1S/C16H23O3Si/c1-2-3-4-5-6-9-13-10-7-8-11-14(13)15(12-17)16(18)19-20/h7-8,10-11,15,17H,2-6,9,12H2,1H3
InChIKeyKNSIWXBTFDNPNW-UHFFFAOYSA-N
XLogP2.90
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 175501209?
The IUPAC name of CID 175501209 (CID 175501209) is not available.
What is the SMILES notation for CID 175501209?
The canonical SMILES for CID 175501209 is CCCCCCCc1ccccc1C(CO)C(=O)O[Si].
What is the InChIKey of CID 175501209?
The InChIKey is KNSIWXBTFDNPNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23O3Si/c1-2-3-4-5-6-9-13-10-7-8-11-14(13)15(12-17)16(18)19-20/h7-8,10-11,15,17H,2-6,9,12H2,1H3.
What are the key properties of CID 175501209?
CID 175501209 has a molecular weight of 291.44 g/mol, XLogP of 2.90, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 175501209 is sourced from PubChem (CID 175501209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).