CID 159796358

C4H10ClOSi — CID 159796358

IUPAC—
SMILESCC(C)O[Si].CCl
InChIInChI=1S/C3H7OSi.CH3Cl/c1-3(2)4-5;1-2/h3H,1-2H3;1H3
InChIKeyNJFKTVQIFJQMIV-UHFFFAOYSA-N
MW137.66 g/mol
LogP1.35
Rot. Bonds1

About CID 159796358

CID 159796358 (PubChem CID 159796358) has the molecular formula C4H10ClOSi and a molecular weight of 137.66 g/mol.

Molecular Properties

Compound NameCID 159796358
PubChem CID159796358
Molecular FormulaC4H10ClOSi
Molecular Weight137.66 g/mol
Exact Mass137.02
IUPAC Name—
SMILESCC(C)O[Si].CCl
InChIInChI=1S/C3H7OSi.CH3Cl/c1-3(2)4-5;1-2/h3H,1-2H3;1H3
InChIKeyNJFKTVQIFJQMIV-UHFFFAOYSA-N
XLogP1.35
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.66
LogP ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 159796358?
The IUPAC name of CID 159796358 (CID 159796358) is not available.
What is the SMILES notation for CID 159796358?
The canonical SMILES for CID 159796358 is CC(C)O[Si].CCl.
What is the InChIKey of CID 159796358?
The InChIKey is NJFKTVQIFJQMIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7OSi.CH3Cl/c1-3(2)4-5;1-2/h3H,1-2H3;1H3.
What are the key properties of CID 159796358?
CID 159796358 has a molecular weight of 137.66 g/mol, XLogP of 1.35, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 159796358 is sourced from PubChem (CID 159796358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).