CID 153437987

C5H6ClOSi — CID 153437987

IUPAC—
SMILESC[Si](C)C#CC(=O)Cl
InChIInChI=1S/C5H6ClOSi/c1-8(2)4-3-5(6)7/h1-2H3
InChIKeyDCJNOXIPGOWVTE-UHFFFAOYSA-N
MW145.64 g/mol
LogP1.05
Rot. Bonds

About CID 153437987

CID 153437987 (PubChem CID 153437987) has the molecular formula C5H6ClOSi and a molecular weight of 145.64 g/mol.

Molecular Properties

Compound NameCID 153437987
PubChem CID153437987
Molecular FormulaC5H6ClOSi
Molecular Weight145.64 g/mol
Exact Mass144.99
IUPAC Name—
SMILESC[Si](C)C#CC(=O)Cl
InChIInChI=1S/C5H6ClOSi/c1-8(2)4-3-5(6)7/h1-2H3
InChIKeyDCJNOXIPGOWVTE-UHFFFAOYSA-N
XLogP1.05
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.64
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 153437987?
The IUPAC name of CID 153437987 (CID 153437987) is not available.
What is the SMILES notation for CID 153437987?
The canonical SMILES for CID 153437987 is C[Si](C)C#CC(=O)Cl.
What is the InChIKey of CID 153437987?
The InChIKey is DCJNOXIPGOWVTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6ClOSi/c1-8(2)4-3-5(6)7/h1-2H3.
What are the key properties of CID 153437987?
CID 153437987 has a molecular weight of 145.64 g/mol, XLogP of 1.05, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 153437987 is sourced from PubChem (CID 153437987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).