CID 175952399

C15H26LiOSi — CID 175952399

IUPAC—
SMILESCC(C)c1cc([Si](C)(C)C)cc(C(C)C)c1O.[Li]
InChIInChI=1S/C15H26OSi.Li/c1-10(2)13-8-12(17(5,6)7)9-14(11(3)4)15(13)16;/h8-11,16H,1-7H3;
InChIKeySJEAAANNZPYNOY-UHFFFAOYSA-N
MW257.40 g/mol
LogP3.80
Rot. Bonds3

About CID 175952399

CID 175952399 (PubChem CID 175952399) has the molecular formula C15H26LiOSi and a molecular weight of 257.40 g/mol.

Molecular Properties

Compound NameCID 175952399
PubChem CID175952399
Molecular FormulaC15H26LiOSi
Molecular Weight257.40 g/mol
Exact Mass257.19
IUPAC Name—
SMILESCC(C)c1cc([Si](C)(C)C)cc(C(C)C)c1O.[Li]
InChIInChI=1S/C15H26OSi.Li/c1-10(2)13-8-12(17(5,6)7)9-14(11(3)4)15(13)16;/h8-11,16H,1-7H3;
InChIKeySJEAAANNZPYNOY-UHFFFAOYSA-N
XLogP3.80
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.40
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 175952399?
The IUPAC name of CID 175952399 (CID 175952399) is not available.
What is the SMILES notation for CID 175952399?
The canonical SMILES for CID 175952399 is CC(C)c1cc([Si](C)(C)C)cc(C(C)C)c1O.[Li].
What is the InChIKey of CID 175952399?
The InChIKey is SJEAAANNZPYNOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26OSi.Li/c1-10(2)13-8-12(17(5,6)7)9-14(11(3)4)15(13)16;/h8-11,16H,1-7H3;.
What are the key properties of CID 175952399?
CID 175952399 has a molecular weight of 257.40 g/mol, XLogP of 3.80, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 175952399 is sourced from PubChem (CID 175952399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).