1,3,2,4λ2-dioxathiastannetane 2,2-dioxide;hexahydrate

H12O10SSn — CID 142030753

IUPAC1,3,2,4λ2-dioxathiastannetane 2,2-dioxide;hexahydrate
SMILESO.O.O.O.O.O.O=S1(=O)O[Sn]O1
InChIInChI=1S/H2O4S.6H2O.Sn/c1-5(2,3)4;;;;;;;/h(H2,1,2,3,4);6*1H2;/q;;;;;;;+2/p-2
InChIKeyGSKHUBOICIBVBU-UHFFFAOYSA-L
MW322.86 g/mol
LogP-6.14
Rot. Bonds

About 1,3,2,4λ2-dioxathiastannetane 2,2-dioxide;hexahydrate

1,3,2,4λ2-dioxathiastannetane 2,2-dioxide;hexahydrate (PubChem CID 142030753) has the molecular formula H12O10SSn and a molecular weight of 322.86 g/mol. Its IUPAC name is 1,3,2,4λ2-dioxathiastannetane 2,2-dioxide;hexahydrate.

Molecular Properties

Compound Name1,3,2,4λ2-dioxathiastannetane 2,2-dioxide;hexahydrate
PubChem CID142030753
Molecular FormulaH12O10SSn
Molecular Weight322.86 g/mol
Exact Mass323.92
IUPAC Name1,3,2,4λ2-dioxathiastannetane 2,2-dioxide;hexahydrate
SMILESO.O.O.O.O.O.O=S1(=O)O[Sn]O1
InChIInChI=1S/H2O4S.6H2O.Sn/c1-5(2,3)4;;;;;;;/h(H2,1,2,3,4);6*1H2;/q;;;;;;;+2/p-2
InChIKeyGSKHUBOICIBVBU-UHFFFAOYSA-L
XLogP-6.14
TPSA241.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.86
LogP ≤ 5-6.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

CID 175889076
CID 175889076
copper;trioxathietane 4,4-dioxide
CID 174193001
4-N,4-N,4-N',4-N'-tetramethyl-2,2-dioxo-1,3,2-dioxathietane-4,4-diamine
CID 175706695
4,5-diethyl-4,5-dimethyl-1,3,2-dioxathiolane 2,2-dioxide
CID 146263627
1,2,4,3-trioxathiane 3,3-dioxide;hydrate
CID 174833431
vanadium;tetrahydrate
CID 6102325
4-chloro-4,5,5-trifluoro-1,3,2-dioxathiolane 2,2-dioxide
CID 158657256
5,5,6,6-tetramethyl-1,3,2,4-dioxadithiane 2,2,4,4-tetraoxide
CID 71337149
4,4,5-trimethyl-1,3,2-dioxathiolane 2,2-dioxide
CID 140558399
3,4,4-trifluoro-2-hydroxy-1-oxa-2λ6-thiacyclobut-2-ene 2-oxide
CID 123700396
5,5-dioxo-4-oxa-5λ6-thiaspiro[2.4]heptan-7-one
CID 170914086
4-fluoro-4-(trifluoromethyl)oxathietane 2,2-dioxide
CID 134896403

Frequently Asked Questions

What is the IUPAC name of 1,3,2,4λ2-dioxathiastannetane 2,2-dioxide;hexahydrate?
The IUPAC name of 1,3,2,4λ2-dioxathiastannetane 2,2-dioxide;hexahydrate (CID 142030753) is 1,3,2,4λ2-dioxathiastannetane 2,2-dioxide;hexahydrate.
What is the SMILES notation for 1,3,2,4λ2-dioxathiastannetane 2,2-dioxide;hexahydrate?
The canonical SMILES for 1,3,2,4λ2-dioxathiastannetane 2,2-dioxide;hexahydrate is O.O.O.O.O.O.O=S1(=O)O[Sn]O1.
What is the InChIKey of 1,3,2,4λ2-dioxathiastannetane 2,2-dioxide;hexahydrate?
The InChIKey is GSKHUBOICIBVBU-UHFFFAOYSA-L. The full InChI is InChI=1S/H2O4S.6H2O.Sn/c1-5(2,3)4;;;;;;;/h(H2,1,2,3,4);6*1H2;/q;;;;;;;+2/p-2.
What are the key properties of 1,3,2,4λ2-dioxathiastannetane 2,2-dioxide;hexahydrate?
1,3,2,4λ2-dioxathiastannetane 2,2-dioxide;hexahydrate has a molecular weight of 322.86 g/mol, XLogP of -6.14, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,2,4λ2-dioxathiastannetane 2,2-dioxide;hexahydrate is sourced from PubChem (CID 142030753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).