CID 18338446

C14H28O3Si- — CID 18338446

IUPAC—
SMILESCOC(=O)C1(O[Si-](C(C)C)(C(C)C)C(C)C)CC1
InChIInChI=1S/C14H28O3Si/c1-10(2)18(11(3)4,12(5)6)17-14(8-9-14)13(15)16-7/h10-12H,8-9H2,1-7H3/q-1
InChIKeyQUDKALAWHYHCPS-UHFFFAOYSA-N
MW272.46 g/mol
LogP3.88
Rot. Bonds6

About CID 18338446

CID 18338446 (PubChem CID 18338446) has the molecular formula C14H28O3Si- and a molecular weight of 272.46 g/mol.

Molecular Properties

Compound NameCID 18338446
PubChem CID18338446
Molecular FormulaC14H28O3Si-
Molecular Weight272.46 g/mol
Exact Mass272.18
IUPAC Name—
SMILESCOC(=O)C1(O[Si-](C(C)C)(C(C)C)C(C)C)CC1
InChIInChI=1S/C14H28O3Si/c1-10(2)18(11(3)4,12(5)6)17-14(8-9-14)13(15)16-7/h10-12H,8-9H2,1-7H3/q-1
InChIKeyQUDKALAWHYHCPS-UHFFFAOYSA-N
XLogP3.88
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.46
LogP ≤ 53.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 18338446?
The IUPAC name of CID 18338446 (CID 18338446) is not available.
What is the SMILES notation for CID 18338446?
The canonical SMILES for CID 18338446 is COC(=O)C1(O[Si-](C(C)C)(C(C)C)C(C)C)CC1.
What is the InChIKey of CID 18338446?
The InChIKey is QUDKALAWHYHCPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O3Si/c1-10(2)18(11(3)4,12(5)6)17-14(8-9-14)13(15)16-7/h10-12H,8-9H2,1-7H3/q-1.
What are the key properties of CID 18338446?
CID 18338446 has a molecular weight of 272.46 g/mol, XLogP of 3.88, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 18338446 is sourced from PubChem (CID 18338446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).