sodium;hydride;pentakis(trihydroxy(sulfanylidene)-λ5-phosphane)

H16NaO15P5S5 — CID 175387653

IUPACsodium;hydride;pentakis(trihydroxy(sulfanylidene)-λ5-phosphane)
SMILESOP(O)(O)=S.OP(O)(O)=S.OP(O)(O)=S.OP(O)(O)=S.OP(O)(O)=S.[H-].[Na+]
InChIInChI=1S/Na.5H3O3PS.H/c;5*1-4(2,3)5;/h;5*(H3,1,2,3,5);/q+1;;;;;;-1
InChIKeyYSMNPHWOOIREKG-UHFFFAOYSA-N
MW594.31 g/mol
LogP-6.94
Rot. Bonds

About sodium;hydride;pentakis(trihydroxy(sulfanylidene)-λ5-phosphane)

sodium;hydride;pentakis(trihydroxy(sulfanylidene)-λ5-phosphane) (PubChem CID 175387653) has the molecular formula H16NaO15P5S5 and a molecular weight of 594.31 g/mol. Its IUPAC name is sodium;hydride;pentakis(trihydroxy(sulfanylidene)-λ5-phosphane).

Molecular Properties

Compound Namesodium;hydride;pentakis(trihydroxy(sulfanylidene)-λ5-phosphane)
PubChem CID175387653
Molecular FormulaH16NaO15P5S5
Molecular Weight594.31 g/mol
Exact Mass593.77
IUPAC Namesodium;hydride;pentakis(trihydroxy(sulfanylidene)-λ5-phosphane)
SMILESOP(O)(O)=S.OP(O)(O)=S.OP(O)(O)=S.OP(O)(O)=S.OP(O)(O)=S.[H-].[Na+]
InChIInChI=1S/Na.5H3O3PS.H/c;5*1-4(2,3)5;/h;5*(H3,1,2,3,5);/q+1;;;;;;-1
InChIKeyYSMNPHWOOIREKG-UHFFFAOYSA-N
XLogP-6.94
TPSA303.45 Ų
H-Bond Donors15
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms26
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500594.31
LogP ≤ 5-6.94
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

sodium;ethane;hydride;bis(trihydroxy(sulfanylidene)-λ5-phosphane)
CID 173048196
magnesium;hydride;trihydroxy(sulfanylidene)-λ5-phosphane
CID 174644502
lithium;hydride;trihydroxy(sulfanylidene)-λ5-phosphane;hydrochloride
CID 175073522
CID 173186715
CID 173186715
CID 173075577
CID 173075577
tetrakis(trihydroxy(sulfanylidene)-λ5-phosphane);zinc
CID 174914506
molybdenum;rhenium;trihydroxy(sulfanylidene)-λ5-phosphane
CID 174835711
azanide;bis(trihydroxy(sulfanylidene)-λ5-phosphane);zinc
CID 174724597
bis(trihydroxy(sulfanylidene)-λ5-phosphane);zinc;dihydrate
CID 175281748
ethane;methane;bis(trihydroxy(sulfanylidene)-λ5-phosphane)
CID 175324813
sodium;N-ethylethanamine;hydride;trihydroxy(sulfanylidene)-λ5-phosphane
CID 174630751
azane;boric acid;trihydroxy(sulfanylidene)-λ5-phosphane
CID 175125290

Frequently Asked Questions

What is the IUPAC name of sodium;hydride;pentakis(trihydroxy(sulfanylidene)-λ5-phosphane)?
The IUPAC name of sodium;hydride;pentakis(trihydroxy(sulfanylidene)-λ5-phosphane) (CID 175387653) is sodium;hydride;pentakis(trihydroxy(sulfanylidene)-λ5-phosphane).
What is the SMILES notation for sodium;hydride;pentakis(trihydroxy(sulfanylidene)-λ5-phosphane)?
The canonical SMILES for sodium;hydride;pentakis(trihydroxy(sulfanylidene)-λ5-phosphane) is OP(O)(O)=S.OP(O)(O)=S.OP(O)(O)=S.OP(O)(O)=S.OP(O)(O)=S.[H-].[Na+].
What is the InChIKey of sodium;hydride;pentakis(trihydroxy(sulfanylidene)-λ5-phosphane)?
The InChIKey is YSMNPHWOOIREKG-UHFFFAOYSA-N. The full InChI is InChI=1S/Na.5H3O3PS.H/c;5*1-4(2,3)5;/h;5*(H3,1,2,3,5);/q+1;;;;;;-1.
What are the key properties of sodium;hydride;pentakis(trihydroxy(sulfanylidene)-λ5-phosphane)?
sodium;hydride;pentakis(trihydroxy(sulfanylidene)-λ5-phosphane) has a molecular weight of 594.31 g/mol, XLogP of -6.94, 0 rotatable bonds, 15 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;hydride;pentakis(trihydroxy(sulfanylidene)-λ5-phosphane) is sourced from PubChem (CID 175387653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).