CID 142076388

C12H26OSi- — CID 142076388

IUPAC—
SMILESCC[Si-](CC)(CC)OC1CCCC1C
InChIInChI=1S/C12H26OSi/c1-5-14(6-2,7-3)13-12-10-8-9-11(12)4/h11-12H,5-10H2,1-4H3/q-1
InChIKeyHWFACGNTBOCJMH-UHFFFAOYSA-N
MW214.42 g/mol
LogP4.20
Rot. Bonds5

About CID 142076388

CID 142076388 (PubChem CID 142076388) has the molecular formula C12H26OSi- and a molecular weight of 214.42 g/mol.

Molecular Properties

Compound NameCID 142076388
PubChem CID142076388
Molecular FormulaC12H26OSi-
Molecular Weight214.42 g/mol
Exact Mass214.18
IUPAC Name—
SMILESCC[Si-](CC)(CC)OC1CCCC1C
InChIInChI=1S/C12H26OSi/c1-5-14(6-2,7-3)13-12-10-8-9-11(12)4/h11-12H,5-10H2,1-4H3/q-1
InChIKeyHWFACGNTBOCJMH-UHFFFAOYSA-N
XLogP4.20
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.42
LogP ≤ 54.20
H-Bond Donors ≤ 50
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 142076388?
The IUPAC name of CID 142076388 (CID 142076388) is not available.
What is the SMILES notation for CID 142076388?
The canonical SMILES for CID 142076388 is CC[Si-](CC)(CC)OC1CCCC1C.
What is the InChIKey of CID 142076388?
The InChIKey is HWFACGNTBOCJMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26OSi/c1-5-14(6-2,7-3)13-12-10-8-9-11(12)4/h11-12H,5-10H2,1-4H3/q-1.
What are the key properties of CID 142076388?
CID 142076388 has a molecular weight of 214.42 g/mol, XLogP of 4.20, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 142076388 is sourced from PubChem (CID 142076388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).