CID 170961653

C8H18ClSi — CID 170961653

IUPAC—
SMILESCC(C)C(C)(Cl)C[Si](C)C
InChIInChI=1S/C8H18ClSi/c1-7(2)8(3,9)6-10(4)5/h7H,6H2,1-5H3
InChIKeyATXZXDCQGRKUKK-UHFFFAOYSA-N
MW177.77 g/mol
LogP3.39
Rot. Bonds3

About CID 170961653

CID 170961653 (PubChem CID 170961653) has the molecular formula C8H18ClSi and a molecular weight of 177.77 g/mol.

Molecular Properties

Compound NameCID 170961653
PubChem CID170961653
Molecular FormulaC8H18ClSi
Molecular Weight177.77 g/mol
Exact Mass177.09
IUPAC Name—
SMILESCC(C)C(C)(Cl)C[Si](C)C
InChIInChI=1S/C8H18ClSi/c1-7(2)8(3,9)6-10(4)5/h7H,6H2,1-5H3
InChIKeyATXZXDCQGRKUKK-UHFFFAOYSA-N
XLogP3.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.77
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 170961653?
The IUPAC name of CID 170961653 (CID 170961653) is not available.
What is the SMILES notation for CID 170961653?
The canonical SMILES for CID 170961653 is CC(C)C(C)(Cl)C[Si](C)C.
What is the InChIKey of CID 170961653?
The InChIKey is ATXZXDCQGRKUKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18ClSi/c1-7(2)8(3,9)6-10(4)5/h7H,6H2,1-5H3.
What are the key properties of CID 170961653?
CID 170961653 has a molecular weight of 177.77 g/mol, XLogP of 3.39, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 170961653 is sourced from PubChem (CID 170961653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).