tricyanatostannyl cyanate

C4N4O4Sn — CID 141124665

IUPACtricyanatostannyl cyanate
SMILESN#CO[Sn](OC#N)(OC#N)OC#N
InChIInChI=1S/4CHNO.Sn/c4*2-1-3;/h4*3H;/q;;;;+4/p-4
InChIKeyBOKFFWAZSUYMFB-UHFFFAOYSA-J
MW286.78 g/mol
LogP-0.59
Rot. Bonds4

About tricyanatostannyl cyanate

tricyanatostannyl cyanate (PubChem CID 141124665) has the molecular formula C4N4O4Sn and a molecular weight of 286.78 g/mol. Its IUPAC name is tricyanatostannyl cyanate.

Molecular Properties

Compound Nametricyanatostannyl cyanate
PubChem CID141124665
Molecular FormulaC4N4O4Sn
Molecular Weight286.78 g/mol
Exact Mass287.89
IUPAC Nametricyanatostannyl cyanate
SMILESN#CO[Sn](OC#N)(OC#N)OC#N
InChIInChI=1S/4CHNO.Sn/c4*2-1-3;/h4*3H;/q;;;;+4/p-4
InChIKeyBOKFFWAZSUYMFB-UHFFFAOYSA-J
XLogP-0.59
TPSA132.08 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.78
LogP ≤ 5-0.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cyanate_/aminonitrile_/thiocyanate', 'substructure': 'N/A'}

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Related Compounds

sodium;hydride;phosphanyl cyanate
CID 174818007
strontium cyanamide
CID 22399917
sodium;fluoro cyanate;hydride
CID 175390486
(cyanatodiazenyl) cyanate
CID 175722375
potassium;amino cyanate;hydride
CID 174784610
cyanatosulfanyl cyanate
CID 54444276
barium(2+);bromo cyanate;hydride
CID 174987279
methyl N'-cyanocarbamimidate
CID 15646036
bromo peroxycyanate
CID 162697951
azane;cyanatosulfanyl cyanate
CID 88610556
ruthenium;dihydrate
CID 172843404
scandium;hexahydrate
CID 159475498

Frequently Asked Questions

What is the IUPAC name of tricyanatostannyl cyanate?
The IUPAC name of tricyanatostannyl cyanate (CID 141124665) is tricyanatostannyl cyanate.
What is the SMILES notation for tricyanatostannyl cyanate?
The canonical SMILES for tricyanatostannyl cyanate is N#CO[Sn](OC#N)(OC#N)OC#N.
What is the InChIKey of tricyanatostannyl cyanate?
The InChIKey is BOKFFWAZSUYMFB-UHFFFAOYSA-J. The full InChI is InChI=1S/4CHNO.Sn/c4*2-1-3;/h4*3H;/q;;;;+4/p-4.
What are the key properties of tricyanatostannyl cyanate?
tricyanatostannyl cyanate has a molecular weight of 286.78 g/mol, XLogP of -0.59, 4 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for tricyanatostannyl cyanate is sourced from PubChem (CID 141124665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).