CID 155660222

C6H15O2SSi — CID 155660222

IUPAC—
SMILESCCO[Si](CS)CCOC
InChIInChI=1S/C6H15O2SSi/c1-3-8-10(6-9)5-4-7-2/h9H,3-6H2,1-2H3
InChIKeyKQBXUYFCBLPQLL-UHFFFAOYSA-N
MW179.34 g/mol
LogP1.13
Rot. Bonds6

About CID 155660222

CID 155660222 (PubChem CID 155660222) has the molecular formula C6H15O2SSi and a molecular weight of 179.34 g/mol.

Molecular Properties

Compound NameCID 155660222
PubChem CID155660222
Molecular FormulaC6H15O2SSi
Molecular Weight179.34 g/mol
Exact Mass179.06
IUPAC Name—
SMILESCCO[Si](CS)CCOC
InChIInChI=1S/C6H15O2SSi/c1-3-8-10(6-9)5-4-7-2/h9H,3-6H2,1-2H3
InChIKeyKQBXUYFCBLPQLL-UHFFFAOYSA-N
XLogP1.13
TPSA18.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.34
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Related Compounds

CID 123430545
CID 123430545
1-(3-ethoxypropoxy)-4-methoxybutane
CID 59660847
1,2-dimethoxyethane;ethane
CID 91349162
methane;methoxyethane
CID 158573885
methoxyethane;hydroiodide
CID 162009435
1,2-dimethoxyethane;samarium
CID 174304250
bis(1-ethoxy-2-methoxyethane);hydrate
CID 88797439
1-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]-2-methoxyethane
CID 19982973
1,2-dimethoxyethane;1-ethoxy-2-(2-ethoxyethoxy)ethane
CID 159445382
Dimethyl [2-(diethoxysilyl)ethyl]phosphonate
CID 86246824
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanethiol
CID 86092592
1-(2-ethoxyethoxy)-2-methoxyethane;methane
CID 162070739

Frequently Asked Questions

What is the IUPAC name of CID 155660222?
The IUPAC name of CID 155660222 (CID 155660222) is not available.
What is the SMILES notation for CID 155660222?
The canonical SMILES for CID 155660222 is CCO[Si](CS)CCOC.
What is the InChIKey of CID 155660222?
The InChIKey is KQBXUYFCBLPQLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15O2SSi/c1-3-8-10(6-9)5-4-7-2/h9H,3-6H2,1-2H3.
What are the key properties of CID 155660222?
CID 155660222 has a molecular weight of 179.34 g/mol, XLogP of 1.13, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 155660222 is sourced from PubChem (CID 155660222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).