CID 136717692

C11H17Cl2Si — CID 136717692

IUPAC—
SMILESCCC1([Si](Cl)Cl)C(C)=C(C)C(C)=C1C
InChIInChI=1S/C11H17Cl2Si/c1-6-11(14(12)13)9(4)7(2)8(3)10(11)5/h6H2,1-5H3
InChIKeyZQIRVQBCBWXVEG-UHFFFAOYSA-N
MW248.25 g/mol
LogP4.79
Rot. Bonds2

About CID 136717692

CID 136717692 (PubChem CID 136717692) has the molecular formula C11H17Cl2Si and a molecular weight of 248.25 g/mol.

Molecular Properties

Compound NameCID 136717692
PubChem CID136717692
Molecular FormulaC11H17Cl2Si
Molecular Weight248.25 g/mol
Exact Mass247.05
IUPAC Name—
SMILESCCC1([Si](Cl)Cl)C(C)=C(C)C(C)=C1C
InChIInChI=1S/C11H17Cl2Si/c1-6-11(14(12)13)9(4)7(2)8(3)10(11)5/h6H2,1-5H3
InChIKeyZQIRVQBCBWXVEG-UHFFFAOYSA-N
XLogP4.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.25
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 136717692?
The IUPAC name of CID 136717692 (CID 136717692) is not available.
What is the SMILES notation for CID 136717692?
The canonical SMILES for CID 136717692 is CCC1([Si](Cl)Cl)C(C)=C(C)C(C)=C1C.
What is the InChIKey of CID 136717692?
The InChIKey is ZQIRVQBCBWXVEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17Cl2Si/c1-6-11(14(12)13)9(4)7(2)8(3)10(11)5/h6H2,1-5H3.
What are the key properties of CID 136717692?
CID 136717692 has a molecular weight of 248.25 g/mol, XLogP of 4.79, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 136717692 is sourced from PubChem (CID 136717692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).