CID 10666490

C20H32O4Si — CID 10666490

IUPAC—
SMILESCC[Si](CC)(CC)O[C@@H]1[C@@H]2C=CC(O)C2=C(C)C2(CC2)C12OCCO2
InChIInChI=1S/C20H32O4Si/c1-5-25(6-2,7-3)24-18-15-8-9-16(21)17(15)14(4)19(10-11-19)20(18)22-12-13-23-20/h8-9,15-16,18,21H,5-7,10-13H2,1-4H3/t15-,16?,18-/m1/s1
InChIKeyVTRWLSZBQHXOJT-IFJNFQAOSA-N
MW364.56 g/mol
LogP3.78
Rot. Bonds5

About CID 10666490

CID 10666490 (PubChem CID 10666490) has the molecular formula C20H32O4Si and a molecular weight of 364.56 g/mol.

Molecular Properties

Compound NameCID 10666490
PubChem CID10666490
Molecular FormulaC20H32O4Si
Molecular Weight364.56 g/mol
Exact Mass364.21
IUPAC Name—
SMILESCC[Si](CC)(CC)O[C@@H]1[C@@H]2C=CC(O)C2=C(C)C2(CC2)C12OCCO2
InChIInChI=1S/C20H32O4Si/c1-5-25(6-2,7-3)24-18-15-8-9-16(21)17(15)14(4)19(10-11-19)20(18)22-12-13-23-20/h8-9,15-16,18,21H,5-7,10-13H2,1-4H3/t15-,16?,18-/m1/s1
InChIKeyVTRWLSZBQHXOJT-IFJNFQAOSA-N
XLogP3.78
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.56
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 10666490?
The IUPAC name of CID 10666490 (CID 10666490) is not available.
What is the SMILES notation for CID 10666490?
The canonical SMILES for CID 10666490 is CC[Si](CC)(CC)O[C@@H]1[C@@H]2C=CC(O)C2=C(C)C2(CC2)C12OCCO2.
What is the InChIKey of CID 10666490?
The InChIKey is VTRWLSZBQHXOJT-IFJNFQAOSA-N. The full InChI is InChI=1S/C20H32O4Si/c1-5-25(6-2,7-3)24-18-15-8-9-16(21)17(15)14(4)19(10-11-19)20(18)22-12-13-23-20/h8-9,15-16,18,21H,5-7,10-13H2,1-4H3/t15-,16?,18-/m1/s1.
What are the key properties of CID 10666490?
CID 10666490 has a molecular weight of 364.56 g/mol, XLogP of 3.78, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 10666490 is sourced from PubChem (CID 10666490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).