CID 123513232

C4H11O3Si — CID 123513232

IUPAC—
SMILESCOC([SiH2])(OC)OC
InChIInChI=1S/C4H11O3Si/c1-5-4(8,6-2)7-3/h8H2,1-3H3
InChIKeyAMBOPHHBAACSGL-UHFFFAOYSA-N
MW135.22 g/mol
LogP-0.83
Rot. Bonds3

About CID 123513232

CID 123513232 (PubChem CID 123513232) has the molecular formula C4H11O3Si and a molecular weight of 135.22 g/mol.

Molecular Properties

Compound NameCID 123513232
PubChem CID123513232
Molecular FormulaC4H11O3Si
Molecular Weight135.22 g/mol
Exact Mass135.05
IUPAC Name—
SMILESCOC([SiH2])(OC)OC
InChIInChI=1S/C4H11O3Si/c1-5-4(8,6-2)7-3/h8H2,1-3H3
InChIKeyAMBOPHHBAACSGL-UHFFFAOYSA-N
XLogP-0.83
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.22
LogP ≤ 5-0.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze CID 123513232 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

CID 173405107
CID 173405107
2-methoxy-2-methylpropane;hydrate
CID 23212559
hydron;2-methoxy-2-methylpropane
CID 174107716
CID 15401192
CID 15401192
dilithium;hydride;methoxymethane
CID 174929904
hydrazine;2-methoxy-2-methylpropane
CID 158568740
2,3-difluoro-2,3-dimethoxybutane
CID 174333179
CID 20657779
CID 20657779
trimethoxymethanol
CID 22386239
1,1,1-trimethoxyethane;hydrochloride
CID 162313346
2,2-dimethoxypropane;methane
CID 162063722
CID 164684188
CID 164684188

Frequently Asked Questions

What is the IUPAC name of CID 123513232?
The IUPAC name of CID 123513232 (CID 123513232) is not available.
What is the SMILES notation for CID 123513232?
The canonical SMILES for CID 123513232 is COC([SiH2])(OC)OC.
What is the InChIKey of CID 123513232?
The InChIKey is AMBOPHHBAACSGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11O3Si/c1-5-4(8,6-2)7-3/h8H2,1-3H3.
What are the key properties of CID 123513232?
CID 123513232 has a molecular weight of 135.22 g/mol, XLogP of -0.83, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 123513232 is sourced from PubChem (CID 123513232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).