CID 19011019

C20H37O6Si — CID 19011019

IUPAC—
SMILESCCOC(C)OC1CC(=O)C(C(O[Si](C)C)C(C)(C)C)C2OC(C)(C)OC12
InChIInChI=1S/C20H37O6Si/c1-10-22-12(2)23-14-11-13(21)15(17-16(14)24-20(6,7)25-17)18(19(3,4)5)26-27(8)9/h12,14-18H,10-11H2,1-9H3
InChIKeyASQYWBUKBVWTFM-UHFFFAOYSA-N
MW401.60 g/mol
LogP3.55
Rot. Bonds7

About CID 19011019

CID 19011019 (PubChem CID 19011019) has the molecular formula C20H37O6Si and a molecular weight of 401.60 g/mol.

Molecular Properties

Compound NameCID 19011019
PubChem CID19011019
Molecular FormulaC20H37O6Si
Molecular Weight401.60 g/mol
Exact Mass401.24
IUPAC Name—
SMILESCCOC(C)OC1CC(=O)C(C(O[Si](C)C)C(C)(C)C)C2OC(C)(C)OC12
InChIInChI=1S/C20H37O6Si/c1-10-22-12(2)23-14-11-13(21)15(17-16(14)24-20(6,7)25-17)18(19(3,4)5)26-27(8)9/h12,14-18H,10-11H2,1-9H3
InChIKeyASQYWBUKBVWTFM-UHFFFAOYSA-N
XLogP3.55
TPSA63.22 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.60
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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 19011019?
The IUPAC name of CID 19011019 (CID 19011019) is not available.
What is the SMILES notation for CID 19011019?
The canonical SMILES for CID 19011019 is CCOC(C)OC1CC(=O)C(C(O[Si](C)C)C(C)(C)C)C2OC(C)(C)OC12.
What is the InChIKey of CID 19011019?
The InChIKey is ASQYWBUKBVWTFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H37O6Si/c1-10-22-12(2)23-14-11-13(21)15(17-16(14)24-20(6,7)25-17)18(19(3,4)5)26-27(8)9/h12,14-18H,10-11H2,1-9H3.
What are the key properties of CID 19011019?
CID 19011019 has a molecular weight of 401.60 g/mol, XLogP of 3.55, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for CID 19011019 is sourced from PubChem (CID 19011019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).