pentanedioic acid;stibane

C5H11O4Sb — CID 173344083

IUPACpentanedioic acid;stibane
SMILESO=C(O)CCCC(=O)O.[SbH3]
InChIInChI=1S/C5H8O4.Sb.3H/c6-4(7)2-1-3-5(8)9;;;;/h1-3H2,(H,6,7)(H,8,9);;;;
InChIKeyKVKMCHDQWDZZMY-UHFFFAOYSA-N
MW256.90 g/mol
LogP-0.86
Rot. Bonds4

About pentanedioic acid;stibane

pentanedioic acid;stibane (PubChem CID 173344083) has the molecular formula C5H11O4Sb and a molecular weight of 256.90 g/mol. Its IUPAC name is pentanedioic acid;stibane.

Molecular Properties

Compound Namepentanedioic acid;stibane
PubChem CID173344083
Molecular FormulaC5H11O4Sb
Molecular Weight256.90 g/mol
Exact Mass255.97
IUPAC Namepentanedioic acid;stibane
SMILESO=C(O)CCCC(=O)O.[SbH3]
InChIInChI=1S/C5H8O4.Sb.3H/c6-4(7)2-1-3-5(8)9;;;;/h1-3H2,(H,6,7)(H,8,9);;;;
InChIKeyKVKMCHDQWDZZMY-UHFFFAOYSA-N
XLogP-0.86
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.90
LogP ≤ 5-0.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

erbium;pentanedioic acid
CID 87931794
azane;bis(pentanedioic acid)
CID 138524332
CID 87067075
CID 87067075
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 pentanedioic acid;stibane?
The IUPAC name of pentanedioic acid;stibane (CID 173344083) is pentanedioic acid;stibane.
What is the SMILES notation for pentanedioic acid;stibane?
The canonical SMILES for pentanedioic acid;stibane is O=C(O)CCCC(=O)O.[SbH3].
What is the InChIKey of pentanedioic acid;stibane?
The InChIKey is KVKMCHDQWDZZMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8O4.Sb.3H/c6-4(7)2-1-3-5(8)9;;;;/h1-3H2,(H,6,7)(H,8,9);;;;.
What are the key properties of pentanedioic acid;stibane?
pentanedioic acid;stibane has a molecular weight of 256.90 g/mol, XLogP of -0.86, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for pentanedioic acid;stibane is sourced from PubChem (CID 173344083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).