hydroxy-oxo-propyl-tellanylidene-λ6-sulfane

C3H8O2STe — CID 139949635

IUPAChydroxy-oxo-propyl-tellanylidene-λ6-sulfane
SMILESCCCS(=O)(O)=[Te]
InChIInChI=1S/C3H8O2STe/c1-2-3-6(4,5)7/h2-3H2,1H3,(H,4,5,7)
InChIKeyXMMKYMZQFDZFKA-UHFFFAOYSA-N
MW235.76 g/mol
LogP0.24
Rot. Bonds2

About hydroxy-oxo-propyl-tellanylidene-λ6-sulfane

hydroxy-oxo-propyl-tellanylidene-λ6-sulfane (PubChem CID 139949635) has the molecular formula C3H8O2STe and a molecular weight of 235.76 g/mol. Its IUPAC name is hydroxy-oxo-propyl-tellanylidene-λ6-sulfane.

Molecular Properties

Compound Namehydroxy-oxo-propyl-tellanylidene-λ6-sulfane
PubChem CID139949635
Molecular FormulaC3H8O2STe
Molecular Weight235.76 g/mol
Exact Mass237.93
IUPAC Namehydroxy-oxo-propyl-tellanylidene-λ6-sulfane
SMILESCCCS(=O)(O)=[Te]
InChIInChI=1S/C3H8O2STe/c1-2-3-6(4,5)7/h2-3H2,1H3,(H,4,5,7)
InChIKeyXMMKYMZQFDZFKA-UHFFFAOYSA-N
XLogP0.24
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.76
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

CID 121393600
CID 121393600
ethane;pentakis(propane-1-sulfonic acid)
CID 158893831
methanesulfonic acid;propane-1-sulfonic acid
CID 87924907
hydrazine;propane-1-sulfonic acid
CID 159325511
1-propylsulfonylpropane
CID 11709
butane;sulfuric acid;zinc
CID 175431012
1-[1,2,2-tris(propylsulfonyl)ethenylsulfonyl]propane
CID 3457689
N-ethylethanamine;propane-1-sulfonic acid
CID 159426890
dioxetane;propane-1-sulfonic acid
CID 87756026
oxirane;propane-1-sulfonic acid
CID 161099007
propan-1-ol;sulfuric acid
CID 18757021
dihydroxy-methyl-propyl-λ4-sulfane
CID 144593661

Frequently Asked Questions

What is the IUPAC name of hydroxy-oxo-propyl-tellanylidene-λ6-sulfane?
The IUPAC name of hydroxy-oxo-propyl-tellanylidene-λ6-sulfane (CID 139949635) is hydroxy-oxo-propyl-tellanylidene-λ6-sulfane.
What is the SMILES notation for hydroxy-oxo-propyl-tellanylidene-λ6-sulfane?
The canonical SMILES for hydroxy-oxo-propyl-tellanylidene-λ6-sulfane is CCCS(=O)(O)=[Te].
What is the InChIKey of hydroxy-oxo-propyl-tellanylidene-λ6-sulfane?
The InChIKey is XMMKYMZQFDZFKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8O2STe/c1-2-3-6(4,5)7/h2-3H2,1H3,(H,4,5,7).
What are the key properties of hydroxy-oxo-propyl-tellanylidene-λ6-sulfane?
hydroxy-oxo-propyl-tellanylidene-λ6-sulfane has a molecular weight of 235.76 g/mol, XLogP of 0.24, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-oxo-propyl-tellanylidene-λ6-sulfane is sourced from PubChem (CID 139949635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).