potassium;azane;2,3-dihydroxybutanedioic acid;erbium;hydride;octahydrochloride

C4H18Cl8ErKNO6 — CID 174742657

IUPACpotassium;azane;2,3-dihydroxybutanedioic acid;erbium;hydride;octahydrochloride
SMILESCl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.N.O=C(O)C(O)C(O)C(=O)O.[Er].[H-].[K+]
InChIInChI=1S/C4H6O6.8ClH.Er.K.H3N.H/c5-1(3(7)8)2(6)4(9)10;;;;;;;;;;;;/h1-2,5-6H,(H,7,8)(H,9,10);8*1H;;;1H3;/q;;;;;;;;;;+1;;-1
InChIKeyWIEGWHUDOFATDB-UHFFFAOYSA-N
MW666.17 g/mol
LogP-1.47
Rot. Bonds3

About potassium;azane;2,3-dihydroxybutanedioic acid;erbium;hydride;octahydrochloride

potassium;azane;2,3-dihydroxybutanedioic acid;erbium;hydride;octahydrochloride (PubChem CID 174742657) has the molecular formula C4H18Cl8ErKNO6 and a molecular weight of 666.17 g/mol. Its IUPAC name is potassium;azane;2,3-dihydroxybutanedioic acid;erbium;hydride;octahydrochloride.

Molecular Properties

Compound Namepotassium;azane;2,3-dihydroxybutanedioic acid;erbium;hydride;octahydrochloride
PubChem CID174742657
Molecular FormulaC4H18Cl8ErKNO6
Molecular Weight666.17 g/mol
Exact Mass660.76
IUPAC Namepotassium;azane;2,3-dihydroxybutanedioic acid;erbium;hydride;octahydrochloride
SMILESCl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.N.O=C(O)C(O)C(O)C(=O)O.[Er].[H-].[K+]
InChIInChI=1S/C4H6O6.8ClH.Er.K.H3N.H/c5-1(3(7)8)2(6)4(9)10;;;;;;;;;;;;/h1-2,5-6H,(H,7,8)(H,9,10);8*1H;;;1H3;/q;;;;;;;;;;+1;;-1
InChIKeyWIEGWHUDOFATDB-UHFFFAOYSA-N
XLogP-1.47
TPSA150.06 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500666.17
LogP ≤ 5-1.47
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

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Related Compounds

lithium;potassium;2,3-dihydroxybutanedioic acid;hydride
CID 173108062
dipotassium;sodium;2,3-dihydroxybutanedioic acid;hydride
CID 173231446
azane;(2R,3S)-2,3-dihydroxybutanedioic acid
CID 175972290
dilithium;2,3-dihydroxybutanedioic acid;hydride;hydrate
CID 173273256
CID 173054452
CID 173054452
dibismuth;tripotassium;pentakis(2,3-dihydroxybutanedioic acid);tetrahydrate
CID 56963012
barium(2+);2,3-dihydroxybutanedioic acid;hydride;stibane
CID 173390294
alumane;2,3-dihydroxybutanedioic acid
CID 173001814
2,3-dihydroxybutanedioic acid;rhodium
CID 88806318
CID 175721627
CID 175721627
CID 88745910
CID 88745910
(2R,3S)-2,3-dihydroxybutanedioic acid;zinc
CID 175911129

Frequently Asked Questions

What is the IUPAC name of potassium;azane;2,3-dihydroxybutanedioic acid;erbium;hydride;octahydrochloride?
The IUPAC name of potassium;azane;2,3-dihydroxybutanedioic acid;erbium;hydride;octahydrochloride (CID 174742657) is potassium;azane;2,3-dihydroxybutanedioic acid;erbium;hydride;octahydrochloride.
What is the SMILES notation for potassium;azane;2,3-dihydroxybutanedioic acid;erbium;hydride;octahydrochloride?
The canonical SMILES for potassium;azane;2,3-dihydroxybutanedioic acid;erbium;hydride;octahydrochloride is Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.N.O=C(O)C(O)C(O)C(=O)O.[Er].[H-].[K+].
What is the InChIKey of potassium;azane;2,3-dihydroxybutanedioic acid;erbium;hydride;octahydrochloride?
The InChIKey is WIEGWHUDOFATDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6O6.8ClH.Er.K.H3N.H/c5-1(3(7)8)2(6)4(9)10;;;;;;;;;;;;/h1-2,5-6H,(H,7,8)(H,9,10);8*1H;;;1H3;/q;;;;;;;;;;+1;;-1.
What are the key properties of potassium;azane;2,3-dihydroxybutanedioic acid;erbium;hydride;octahydrochloride?
potassium;azane;2,3-dihydroxybutanedioic acid;erbium;hydride;octahydrochloride has a molecular weight of 666.17 g/mol, XLogP of -1.47, 3 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;azane;2,3-dihydroxybutanedioic acid;erbium;hydride;octahydrochloride is sourced from PubChem (CID 174742657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).