CID 19820299

C12H27O2Si — CID 19820299

IUPAC—
SMILESCCCCC(CC)C[Si](C)C(OC)OC
InChIInChI=1S/C12H27O2Si/c1-6-8-9-11(7-2)10-15(5)12(13-3)14-4/h11-12H,6-10H2,1-5H3
InChIKeyFDLWUSQABRBDCS-UHFFFAOYSA-N
MW231.43 g/mol
LogP3.49
Rot. Bonds9

About CID 19820299

CID 19820299 (PubChem CID 19820299) has the molecular formula C12H27O2Si and a molecular weight of 231.43 g/mol.

Molecular Properties

Compound NameCID 19820299
PubChem CID19820299
Molecular FormulaC12H27O2Si
Molecular Weight231.43 g/mol
Exact Mass231.18
IUPAC Name—
SMILESCCCCC(CC)C[Si](C)C(OC)OC
InChIInChI=1S/C12H27O2Si/c1-6-8-9-11(7-2)10-15(5)12(13-3)14-4/h11-12H,6-10H2,1-5H3
InChIKeyFDLWUSQABRBDCS-UHFFFAOYSA-N
XLogP3.49
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.43
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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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Related Compounds

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3-ethylicosane
CID 528487

Frequently Asked Questions

What is the IUPAC name of CID 19820299?
The IUPAC name of CID 19820299 (CID 19820299) is not available.
What is the SMILES notation for CID 19820299?
The canonical SMILES for CID 19820299 is CCCCC(CC)C[Si](C)C(OC)OC.
What is the InChIKey of CID 19820299?
The InChIKey is FDLWUSQABRBDCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27O2Si/c1-6-8-9-11(7-2)10-15(5)12(13-3)14-4/h11-12H,6-10H2,1-5H3.
What are the key properties of CID 19820299?
CID 19820299 has a molecular weight of 231.43 g/mol, XLogP of 3.49, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 19820299 is sourced from PubChem (CID 19820299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).