CID 90174264

C19H22F2O3Si — CID 90174264

IUPAC—
SMILESCC(C)OC(O[Si]c1ccc(-c2ccc(F)c(F)c2)cc1)OC(C)C
InChIInChI=1S/C19H22F2O3Si/c1-12(2)22-19(23-13(3)4)24-25-16-8-5-14(6-9-16)15-7-10-17(20)18(21)11-15/h5-13,19H,1-4H3
InChIKeyWWKOKLUKNCNQHJ-UHFFFAOYSA-N
MW364.46 g/mol
LogP4.03
Rot. Bonds8

About CID 90174264

CID 90174264 (PubChem CID 90174264) has the molecular formula C19H22F2O3Si and a molecular weight of 364.46 g/mol.

Molecular Properties

Compound NameCID 90174264
PubChem CID90174264
Molecular FormulaC19H22F2O3Si
Molecular Weight364.46 g/mol
Exact Mass364.13
IUPAC Name—
SMILESCC(C)OC(O[Si]c1ccc(-c2ccc(F)c(F)c2)cc1)OC(C)C
InChIInChI=1S/C19H22F2O3Si/c1-12(2)22-19(23-13(3)4)24-25-16-8-5-14(6-9-16)15-7-10-17(20)18(21)11-15/h5-13,19H,1-4H3
InChIKeyWWKOKLUKNCNQHJ-UHFFFAOYSA-N
XLogP4.03
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.46
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 90174264?
The IUPAC name of CID 90174264 (CID 90174264) is not available.
What is the SMILES notation for CID 90174264?
The canonical SMILES for CID 90174264 is CC(C)OC(O[Si]c1ccc(-c2ccc(F)c(F)c2)cc1)OC(C)C.
What is the InChIKey of CID 90174264?
The InChIKey is WWKOKLUKNCNQHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22F2O3Si/c1-12(2)22-19(23-13(3)4)24-25-16-8-5-14(6-9-16)15-7-10-17(20)18(21)11-15/h5-13,19H,1-4H3.
What are the key properties of CID 90174264?
CID 90174264 has a molecular weight of 364.46 g/mol, XLogP of 4.03, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 90174264 is sourced from PubChem (CID 90174264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).