CID 177428581

C11H21Si — CID 177428581

IUPAC—
SMILESC=C=C(CCCCCC)[Si](C)C
InChIInChI=1S/C11H21Si/c1-5-7-8-9-10-11(6-2)12(3)4/h2,5,7-10H2,1,3-4H3
InChIKeyIMXHNFVXSVXAGK-UHFFFAOYSA-N
MW181.37 g/mol
LogP3.96
Rot. Bonds6

About CID 177428581

CID 177428581 (PubChem CID 177428581) has the molecular formula C11H21Si and a molecular weight of 181.37 g/mol.

Molecular Properties

Compound NameCID 177428581
PubChem CID177428581
Molecular FormulaC11H21Si
Molecular Weight181.37 g/mol
Exact Mass181.14
IUPAC Name—
SMILESC=C=C(CCCCCC)[Si](C)C
InChIInChI=1S/C11H21Si/c1-5-7-8-9-10-11(6-2)12(3)4/h2,5,7-10H2,1,3-4H3
InChIKeyIMXHNFVXSVXAGK-UHFFFAOYSA-N
XLogP3.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.37
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 177428581?
The IUPAC name of CID 177428581 (CID 177428581) is not available.
What is the SMILES notation for CID 177428581?
The canonical SMILES for CID 177428581 is C=C=C(CCCCCC)[Si](C)C.
What is the InChIKey of CID 177428581?
The InChIKey is IMXHNFVXSVXAGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21Si/c1-5-7-8-9-10-11(6-2)12(3)4/h2,5,7-10H2,1,3-4H3.
What are the key properties of CID 177428581?
CID 177428581 has a molecular weight of 181.37 g/mol, XLogP of 3.96, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 177428581 is sourced from PubChem (CID 177428581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).