CID 174853584

C10H15OSi — CID 174853584

IUPAC—
SMILESC=C[Si](C)C.Oc1ccccc1
InChIInChI=1S/C6H6O.C4H9Si/c7-6-4-2-1-3-5-6;1-4-5(2)3/h1-5,7H;4H,1H2,2-3H3
InChIKeyVETGBWJWQXUNLJ-UHFFFAOYSA-N
MW179.31 g/mol
LogP2.86
Rot. Bonds1

About CID 174853584

CID 174853584 (PubChem CID 174853584) has the molecular formula C10H15OSi and a molecular weight of 179.31 g/mol.

Molecular Properties

Compound NameCID 174853584
PubChem CID174853584
Molecular FormulaC10H15OSi
Molecular Weight179.31 g/mol
Exact Mass179.09
IUPAC Name—
SMILESC=C[Si](C)C.Oc1ccccc1
InChIInChI=1S/C6H6O.C4H9Si/c7-6-4-2-1-3-5-6;1-4-5(2)3/h1-5,7H;4H,1H2,2-3H3
InChIKeyVETGBWJWQXUNLJ-UHFFFAOYSA-N
XLogP2.86
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.31
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze CID 174853584 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

benzene;phenol;prop-1-ene
CID 174830652
CID 174852857
CID 174852857
neodymium;phenol
CID 154361260
chloroethene;phenol
CID 19792278
ethane;phenol
CID 161156308
ethene;phenol
CID 22228706
benzene;phenol;prop-2-enoic acid
CID 174875932
phenol;styrene
CID 160675765
phenol;chloride
CID 23313261
phenol;phosphane
CID 159689182
CID 67496590
CID 67496590
CID 161001247
CID 161001247

Frequently Asked Questions

What is the IUPAC name of CID 174853584?
The IUPAC name of CID 174853584 (CID 174853584) is not available.
What is the SMILES notation for CID 174853584?
The canonical SMILES for CID 174853584 is C=C[Si](C)C.Oc1ccccc1.
What is the InChIKey of CID 174853584?
The InChIKey is VETGBWJWQXUNLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6O.C4H9Si/c7-6-4-2-1-3-5-6;1-4-5(2)3/h1-5,7H;4H,1H2,2-3H3.
What are the key properties of CID 174853584?
CID 174853584 has a molecular weight of 179.31 g/mol, XLogP of 2.86, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 174853584 is sourced from PubChem (CID 174853584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).