CID 66773581

C10H12O2Si — CID 66773581

IUPAC—
SMILESCC[Si]OC(=O)Cc1ccccc1
InChIInChI=1S/C10H12O2Si/c1-2-13-12-10(11)8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3
InChIKeyAIEPXHVXJHEHPH-UHFFFAOYSA-N
MW192.29 g/mol
LogP1.83
Rot. Bonds4

About CID 66773581

CID 66773581 (PubChem CID 66773581) has the molecular formula C10H12O2Si and a molecular weight of 192.29 g/mol.

Molecular Properties

Compound NameCID 66773581
PubChem CID66773581
Molecular FormulaC10H12O2Si
Molecular Weight192.29 g/mol
Exact Mass192.06
IUPAC Name—
SMILESCC[Si]OC(=O)Cc1ccccc1
InChIInChI=1S/C10H12O2Si/c1-2-13-12-10(11)8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3
InChIKeyAIEPXHVXJHEHPH-UHFFFAOYSA-N
XLogP1.83
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.29
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze CID 66773581 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

ethyl 2-phenylacetate
CID 7590
(2-phenylacetyl) propanoate
CID 91029268
ethyl 2-phenylacetate;hydrate
CID 141257001
CID 172801156
CID 172801156
ethylsilyl 2-phenylacetate
CID 154128233
(2-phenylacetyl)oxy 2-phenylethaneperoxoate
CID 87450697
(2-phenylacetyl) butanoate
CID 54432060
CID 174393592
CID 174393592
methylsilyl 2-phenylacetate
CID 148919799
carbon dioxide;methyl 2-phenylacetate
CID 159198536
acetyloxymethyl 2-phenylacetate
CID 121486345
(2S)-2-(2-phenylacetyl)oxybutanoic acid
CID 124585457

Frequently Asked Questions

What is the IUPAC name of CID 66773581?
The IUPAC name of CID 66773581 (CID 66773581) is not available.
What is the SMILES notation for CID 66773581?
The canonical SMILES for CID 66773581 is CC[Si]OC(=O)Cc1ccccc1.
What is the InChIKey of CID 66773581?
The InChIKey is AIEPXHVXJHEHPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O2Si/c1-2-13-12-10(11)8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3.
What are the key properties of CID 66773581?
CID 66773581 has a molecular weight of 192.29 g/mol, XLogP of 1.83, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 66773581 is sourced from PubChem (CID 66773581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).