CID 136791114

C4H9Cl2OSi2 — CID 136791114

IUPAC—
SMILESC=C[Si](C)(C)O[Si](Cl)Cl
InChIInChI=1S/C4H9Cl2OSi2/c1-4-9(2,3)7-8(5)6/h4H,1H2,2-3H3
InChIKeyKTJHYBCCXKIMTQ-UHFFFAOYSA-N
MW200.19 g/mol
LogP2.40
Rot. Bonds3

About CID 136791114

CID 136791114 (PubChem CID 136791114) has the molecular formula C4H9Cl2OSi2 and a molecular weight of 200.19 g/mol.

Molecular Properties

Compound NameCID 136791114
PubChem CID136791114
Molecular FormulaC4H9Cl2OSi2
Molecular Weight200.19 g/mol
Exact Mass198.96
IUPAC Name—
SMILESC=C[Si](C)(C)O[Si](Cl)Cl
InChIInChI=1S/C4H9Cl2OSi2/c1-4-9(2,3)7-8(5)6/h4H,1H2,2-3H3
InChIKeyKTJHYBCCXKIMTQ-UHFFFAOYSA-N
XLogP2.40
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.19
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 136791114?
The IUPAC name of CID 136791114 (CID 136791114) is not available.
What is the SMILES notation for CID 136791114?
The canonical SMILES for CID 136791114 is C=C[Si](C)(C)O[Si](Cl)Cl.
What is the InChIKey of CID 136791114?
The InChIKey is KTJHYBCCXKIMTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9Cl2OSi2/c1-4-9(2,3)7-8(5)6/h4H,1H2,2-3H3.
What are the key properties of CID 136791114?
CID 136791114 has a molecular weight of 200.19 g/mol, XLogP of 2.40, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 136791114 is sourced from PubChem (CID 136791114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).