CID 167431813

C8H18Cl2Si2 — CID 167431813

IUPAC—
SMILESC[Si](CCCl)CC[Si](C)CCCl
InChIInChI=1S/C8H18Cl2Si2/c1-11(5-3-9)7-8-12(2)6-4-10/h3-8H2,1-2H3
InChIKeyMOSZCOQCBCGHND-UHFFFAOYSA-N
MW241.31 g/mol
LogP3.71
Rot. Bonds7

About CID 167431813

CID 167431813 (PubChem CID 167431813) has the molecular formula C8H18Cl2Si2 and a molecular weight of 241.31 g/mol.

Molecular Properties

Compound NameCID 167431813
PubChem CID167431813
Molecular FormulaC8H18Cl2Si2
Molecular Weight241.31 g/mol
Exact Mass240.03
IUPAC Name—
SMILESC[Si](CCCl)CC[Si](C)CCCl
InChIInChI=1S/C8H18Cl2Si2/c1-11(5-3-9)7-8-12(2)6-4-10/h3-8H2,1-2H3
InChIKeyMOSZCOQCBCGHND-UHFFFAOYSA-N
XLogP3.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.31
LogP ≤ 53.71
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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Frequently Asked Questions

What is the IUPAC name of CID 167431813?
The IUPAC name of CID 167431813 (CID 167431813) is not available.
What is the SMILES notation for CID 167431813?
The canonical SMILES for CID 167431813 is C[Si](CCCl)CC[Si](C)CCCl.
What is the InChIKey of CID 167431813?
The InChIKey is MOSZCOQCBCGHND-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18Cl2Si2/c1-11(5-3-9)7-8-12(2)6-4-10/h3-8H2,1-2H3.
What are the key properties of CID 167431813?
CID 167431813 has a molecular weight of 241.31 g/mol, XLogP of 3.71, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 167431813 is sourced from PubChem (CID 167431813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).