erbium;pentanedioic acid

C5H8ErO4 — CID 87931794

IUPACerbium;pentanedioic acid
SMILESO=C(O)CCCC(=O)O.[Er]
InChIInChI=1S/C5H8O4.Er/c6-4(7)2-1-3-5(8)9;/h1-3H2,(H,6,7)(H,8,9);
InChIKeyZHMXJHURTPXNTN-UHFFFAOYSA-N
MW299.38 g/mol
LogP0.33
Rot. Bonds4

About erbium;pentanedioic acid

erbium;pentanedioic acid (PubChem CID 87931794) has the molecular formula C5H8ErO4 and a molecular weight of 299.38 g/mol. Its IUPAC name is erbium;pentanedioic acid.

Molecular Properties

Compound Nameerbium;pentanedioic acid
PubChem CID87931794
Molecular FormulaC5H8ErO4
Molecular Weight299.38 g/mol
Exact Mass297.97
IUPAC Nameerbium;pentanedioic acid
SMILESO=C(O)CCCC(=O)O.[Er]
InChIInChI=1S/C5H8O4.Er/c6-4(7)2-1-3-5(8)9;/h1-3H2,(H,6,7)(H,8,9);
InChIKeyZHMXJHURTPXNTN-UHFFFAOYSA-N
XLogP0.33
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.38
LogP ≤ 50.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

azane;bis(pentanedioic acid)
CID 138524332
CID 87067075
CID 87067075
pentanedioic acid;stibane
CID 173344083
hydrazine;pentanedioic acid;dihydrate
CID 172730564
chloromethane;pentanedioic acid
CID 159659659
tetradecanedioic acid
CID 13185
decanedioic acid;tris(nonanedioic acid)
CID 159759294
decanedioic acid;hexanedioic acid;nonanedioic acid;octanedioic acid
CID 159068248
decanedioic acid;hexanedioic acid;octanedioic acid
CID 159110511
tridecanedioic acid;undecanedioic acid
CID 158333715
triacontanedioic acid
CID 5322010
heptadecanedioic acid
CID 3083765

Frequently Asked Questions

What is the IUPAC name of erbium;pentanedioic acid?
The IUPAC name of erbium;pentanedioic acid (CID 87931794) is erbium;pentanedioic acid.
What is the SMILES notation for erbium;pentanedioic acid?
The canonical SMILES for erbium;pentanedioic acid is O=C(O)CCCC(=O)O.[Er].
What is the InChIKey of erbium;pentanedioic acid?
The InChIKey is ZHMXJHURTPXNTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8O4.Er/c6-4(7)2-1-3-5(8)9;/h1-3H2,(H,6,7)(H,8,9);.
What are the key properties of erbium;pentanedioic acid?
erbium;pentanedioic acid has a molecular weight of 299.38 g/mol, XLogP of 0.33, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for erbium;pentanedioic acid is sourced from PubChem (CID 87931794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).