hydroxy-methyl-[3-(thiolan-3-yloxy)propyl]silane

C8H18O2SSi — CID 173451762

IUPAChydroxy-methyl-[3-(thiolan-3-yloxy)propyl]silane
SMILESC[SiH](O)CCCOC1CCSC1
InChIInChI=1S/C8H18O2SSi/c1-12(9)6-2-4-10-8-3-5-11-7-8/h8-9,12H,2-7H2,1H3
InChIKeyBIIVBAQBXLHFGC-UHFFFAOYSA-N
MW206.38 g/mol
LogP1.24
Rot. Bonds5

About hydroxy-methyl-[3-(thiolan-3-yloxy)propyl]silane

hydroxy-methyl-[3-(thiolan-3-yloxy)propyl]silane (PubChem CID 173451762) has the molecular formula C8H18O2SSi and a molecular weight of 206.38 g/mol. Its IUPAC name is hydroxy-methyl-[3-(thiolan-3-yloxy)propyl]silane.

Molecular Properties

Compound Namehydroxy-methyl-[3-(thiolan-3-yloxy)propyl]silane
PubChem CID173451762
Molecular FormulaC8H18O2SSi
Molecular Weight206.38 g/mol
Exact Mass206.08
IUPAC Namehydroxy-methyl-[3-(thiolan-3-yloxy)propyl]silane
SMILESC[SiH](O)CCCOC1CCSC1
InChIInChI=1S/C8H18O2SSi/c1-12(9)6-2-4-10-8-3-5-11-7-8/h8-9,12H,2-7H2,1H3
InChIKeyBIIVBAQBXLHFGC-UHFFFAOYSA-N
XLogP1.24
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.38
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of hydroxy-methyl-[3-(thiolan-3-yloxy)propyl]silane?
The IUPAC name of hydroxy-methyl-[3-(thiolan-3-yloxy)propyl]silane (CID 173451762) is hydroxy-methyl-[3-(thiolan-3-yloxy)propyl]silane.
What is the SMILES notation for hydroxy-methyl-[3-(thiolan-3-yloxy)propyl]silane?
The canonical SMILES for hydroxy-methyl-[3-(thiolan-3-yloxy)propyl]silane is C[SiH](O)CCCOC1CCSC1.
What is the InChIKey of hydroxy-methyl-[3-(thiolan-3-yloxy)propyl]silane?
The InChIKey is BIIVBAQBXLHFGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O2SSi/c1-12(9)6-2-4-10-8-3-5-11-7-8/h8-9,12H,2-7H2,1H3.
What are the key properties of hydroxy-methyl-[3-(thiolan-3-yloxy)propyl]silane?
hydroxy-methyl-[3-(thiolan-3-yloxy)propyl]silane has a molecular weight of 206.38 g/mol, XLogP of 1.24, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-methyl-[3-(thiolan-3-yloxy)propyl]silane is sourced from PubChem (CID 173451762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).