potassium cyano carbonate

C2KNO3 — CID 23721505

IUPACpotassium cyano carbonate
SMILESN#COC(=O)[O-].[K+]
InChIInChI=1S/C2HNO3.K/c3-1-6-2(4)5;/h(H,4,5);/q;+1/p-1
InChIKeyCDBJXCDHVRZACS-UHFFFAOYSA-M
MW125.12 g/mol
LogP-4.17
Rot. Bonds

About potassium cyano carbonate

potassium cyano carbonate (PubChem CID 23721505) has the molecular formula C2KNO3 and a molecular weight of 125.12 g/mol. Its IUPAC name is potassium cyano carbonate.

Molecular Properties

Compound Namepotassium cyano carbonate
PubChem CID23721505
Molecular FormulaC2KNO3
Molecular Weight125.12 g/mol
Exact Mass124.95
IUPAC Namepotassium cyano carbonate
SMILESN#COC(=O)[O-].[K+]
InChIInChI=1S/C2HNO3.K/c3-1-6-2(4)5;/h(H,4,5);/q;+1/p-1
InChIKeyCDBJXCDHVRZACS-UHFFFAOYSA-M
XLogP-4.17
TPSA73.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.12
LogP ≤ 5-4.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

tripotassium;cyanoformate;diacetate
CID 173338497
cyano hydroxy carbonate
CID 87497804
cyano 2,2-dimethylpropanoate
CID 141255582
cyano 2-bromoacetate
CID 129281061
potassium (2E)-2-cyano-2-hydroxyiminoacetate
CID 126696371
azane;cyano dibromoboranylformate
CID 87284124
octacesium;oxalate;dihydrate
CID 164888483
oxalate;bis(yttrium(3+));hydrate
CID 516803
zinc;oxalate;hexahydrate
CID 175037581
lanthanum;oxalate;nonahydrate
CID 172983604
iron(3+);oxalate;hydrate
CID 172796672
oxalate;bis(terbium(3+));hydrate
CID 57351143

Frequently Asked Questions

What is the IUPAC name of potassium cyano carbonate?
The IUPAC name of potassium cyano carbonate (CID 23721505) is potassium cyano carbonate.
What is the SMILES notation for potassium cyano carbonate?
The canonical SMILES for potassium cyano carbonate is N#COC(=O)[O-].[K+].
What is the InChIKey of potassium cyano carbonate?
The InChIKey is CDBJXCDHVRZACS-UHFFFAOYSA-M. The full InChI is InChI=1S/C2HNO3.K/c3-1-6-2(4)5;/h(H,4,5);/q;+1/p-1.
What are the key properties of potassium cyano carbonate?
potassium cyano carbonate has a molecular weight of 125.12 g/mol, XLogP of -4.17, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for potassium cyano carbonate is sourced from PubChem (CID 23721505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).