2-hydroxythiasilinan-3-ol

C4H10O2SSi — CID 175444349

IUPAC2-hydroxythiasilinan-3-ol
SMILESOC1CCCS[SiH]1O
InChIInChI=1S/C4H10O2SSi/c5-4-2-1-3-7-8(4)6/h4-6,8H,1-3H2
InChIKeyYPEBAEJJMSWKRJ-UHFFFAOYSA-N
MW150.27 g/mol
LogP-0.37
Rot. Bonds

About 2-hydroxythiasilinan-3-ol

2-hydroxythiasilinan-3-ol (PubChem CID 175444349) has the molecular formula C4H10O2SSi and a molecular weight of 150.27 g/mol. Its IUPAC name is 2-hydroxythiasilinan-3-ol.

Molecular Properties

Compound Name2-hydroxythiasilinan-3-ol
PubChem CID175444349
Molecular FormulaC4H10O2SSi
Molecular Weight150.27 g/mol
Exact Mass150.02
IUPAC Name2-hydroxythiasilinan-3-ol
SMILESOC1CCCS[SiH]1O
InChIInChI=1S/C4H10O2SSi/c5-4-2-1-3-7-8(4)6/h4-6,8H,1-3H2
InChIKeyYPEBAEJJMSWKRJ-UHFFFAOYSA-N
XLogP-0.37
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.27
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxythiasilinan-3-ol?
The IUPAC name of 2-hydroxythiasilinan-3-ol (CID 175444349) is 2-hydroxythiasilinan-3-ol.
What is the SMILES notation for 2-hydroxythiasilinan-3-ol?
The canonical SMILES for 2-hydroxythiasilinan-3-ol is OC1CCCS[SiH]1O.
What is the InChIKey of 2-hydroxythiasilinan-3-ol?
The InChIKey is YPEBAEJJMSWKRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O2SSi/c5-4-2-1-3-7-8(4)6/h4-6,8H,1-3H2.
What are the key properties of 2-hydroxythiasilinan-3-ol?
2-hydroxythiasilinan-3-ol has a molecular weight of 150.27 g/mol, XLogP of -0.37, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxythiasilinan-3-ol is sourced from PubChem (CID 175444349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).