CID 136679685

C12H15Si — CID 136679685

IUPAC—
SMILESC=C[Si](/C=C/CC)c1ccccc1
InChIInChI=1S/C12H15Si/c1-3-5-11-13(4-2)12-9-7-6-8-10-12/h4-11H,2-3H2,1H3/b11-5+
InChIKeyJIXGZYVZZNAIDB-VZUCSPMQSA-N
MW187.34 g/mol
LogP2.62
Rot. Bonds4

About CID 136679685

CID 136679685 (PubChem CID 136679685) has the molecular formula C12H15Si and a molecular weight of 187.34 g/mol.

Molecular Properties

Compound NameCID 136679685
PubChem CID136679685
Molecular FormulaC12H15Si
Molecular Weight187.34 g/mol
Exact Mass187.09
IUPAC Name—
SMILESC=C[Si](/C=C/CC)c1ccccc1
InChIInChI=1S/C12H15Si/c1-3-5-11-13(4-2)12-9-7-6-8-10-12/h4-11H,2-3H2,1H3/b11-5+
InChIKeyJIXGZYVZZNAIDB-VZUCSPMQSA-N
XLogP2.62
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.34
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 136679685?
The IUPAC name of CID 136679685 (CID 136679685) is not available.
What is the SMILES notation for CID 136679685?
The canonical SMILES for CID 136679685 is C=C[Si](/C=C/CC)c1ccccc1.
What is the InChIKey of CID 136679685?
The InChIKey is JIXGZYVZZNAIDB-VZUCSPMQSA-N. The full InChI is InChI=1S/C12H15Si/c1-3-5-11-13(4-2)12-9-7-6-8-10-12/h4-11H,2-3H2,1H3/b11-5+.
What are the key properties of CID 136679685?
CID 136679685 has a molecular weight of 187.34 g/mol, XLogP of 2.62, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 136679685 is sourced from PubChem (CID 136679685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).