CID 67821416

C11H15OSi — CID 67821416

IUPAC—
SMILESCC=COc1ccccc1[Si](C)C
InChIInChI=1S/C11H15OSi/c1-4-9-12-10-7-5-6-8-11(10)13(2)3/h4-9H,1-3H3
InChIKeyKMTHQYWYOOUYIF-UHFFFAOYSA-N
MW191.33 g/mol
LogP2.56
Rot. Bonds3

About CID 67821416

CID 67821416 (PubChem CID 67821416) has the molecular formula C11H15OSi and a molecular weight of 191.33 g/mol.

Molecular Properties

Compound NameCID 67821416
PubChem CID67821416
Molecular FormulaC11H15OSi
Molecular Weight191.33 g/mol
Exact Mass191.09
IUPAC Name—
SMILESCC=COc1ccccc1[Si](C)C
InChIInChI=1S/C11H15OSi/c1-4-9-12-10-7-5-6-8-11(10)13(2)3/h4-9H,1-3H3
InChIKeyKMTHQYWYOOUYIF-UHFFFAOYSA-N
XLogP2.56
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.33
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze CID 67821416 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

Anisole
CID 7519
1,4-Dimethoxybenzene
CID 9016
Phenetole
CID 7674
Butyl phenyl ether
CID 14311
Allyl phenyl ether
CID 74458
Phenyl vinyl ether
CID 69840
Benzene, propoxy-
CID 12155
Pentyl phenyl ether
CID 16298
4-Fluorophenetole
CID 68018
2-Methoxyethyl phenyl ether
CID 96375
2-Fluorophenetole
CID 136291
Benzene, 1-butoxy-4-methoxy-
CID 140754

Frequently Asked Questions

What is the IUPAC name of CID 67821416?
The IUPAC name of CID 67821416 (CID 67821416) is not available.
What is the SMILES notation for CID 67821416?
The canonical SMILES for CID 67821416 is CC=COc1ccccc1[Si](C)C.
What is the InChIKey of CID 67821416?
The InChIKey is KMTHQYWYOOUYIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15OSi/c1-4-9-12-10-7-5-6-8-11(10)13(2)3/h4-9H,1-3H3.
What are the key properties of CID 67821416?
CID 67821416 has a molecular weight of 191.33 g/mol, XLogP of 2.56, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 67821416 is sourced from PubChem (CID 67821416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).