CID 154594606

C12H21PSi+ — CID 154594606

IUPAC—
SMILESC=CC[P+](CC=C)(CC=C)CCC[Si]
InChIInChI=1S/C12H21PSi/c1-4-8-13(9-5-2,10-6-3)11-7-12-14/h4-6H,1-3,7-12H2/q+1
InChIKeyMOSQKIGCSGPXGK-UHFFFAOYSA-N
MW224.36 g/mol
LogP3.54
Rot. Bonds9

About CID 154594606

CID 154594606 (PubChem CID 154594606) has the molecular formula C12H21PSi+ and a molecular weight of 224.36 g/mol.

Molecular Properties

Compound NameCID 154594606
PubChem CID154594606
Molecular FormulaC12H21PSi+
Molecular Weight224.36 g/mol
Exact Mass224.11
IUPAC Name—
SMILESC=CC[P+](CC=C)(CC=C)CCC[Si]
InChIInChI=1S/C12H21PSi/c1-4-8-13(9-5-2,10-6-3)11-7-12-14/h4-6H,1-3,7-12H2/q+1
InChIKeyMOSQKIGCSGPXGK-UHFFFAOYSA-N
XLogP3.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.36
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 18417202
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(4S)-5-iodo-4-methylpent-1-ene
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(4S)-4-iodopent-1-ene
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4-iodopent-1-ene
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Frequently Asked Questions

What is the IUPAC name of CID 154594606?
The IUPAC name of CID 154594606 (CID 154594606) is not available.
What is the SMILES notation for CID 154594606?
The canonical SMILES for CID 154594606 is C=CC[P+](CC=C)(CC=C)CCC[Si].
What is the InChIKey of CID 154594606?
The InChIKey is MOSQKIGCSGPXGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21PSi/c1-4-8-13(9-5-2,10-6-3)11-7-12-14/h4-6H,1-3,7-12H2/q+1.
What are the key properties of CID 154594606?
CID 154594606 has a molecular weight of 224.36 g/mol, XLogP of 3.54, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 154594606 is sourced from PubChem (CID 154594606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).