tris(dipropyl phosphite);indium(3+)

C18H42InO9P3 — CID 23460130

IUPACtris(dipropyl phosphite);indium(3+)
SMILESCCCOP([O-])OCCC.CCCOP([O-])OCCC.CCCOP([O-])OCCC.[In+3]
InChIInChI=1S/3C6H14O3P.In/c3*1-3-5-8-10(7)9-6-4-2;/h3*3-6H2,1-2H3;/q3*-1;+3
InChIKeyLWDIXTNCLFUVGJ-UHFFFAOYSA-N
MW610.27 g/mol
LogP3.90
Rot. Bonds18

About tris(dipropyl phosphite);indium(3+)

tris(dipropyl phosphite);indium(3+) (PubChem CID 23460130) has the molecular formula C18H42InO9P3 and a molecular weight of 610.27 g/mol. Its IUPAC name is tris(dipropyl phosphite);indium(3+).

Molecular Properties

Compound Nametris(dipropyl phosphite);indium(3+)
PubChem CID23460130
Molecular FormulaC18H42InO9P3
Molecular Weight610.27 g/mol
Exact Mass610.11
IUPAC Nametris(dipropyl phosphite);indium(3+)
SMILESCCCOP([O-])OCCC.CCCOP([O-])OCCC.CCCOP([O-])OCCC.[In+3]
InChIInChI=1S/3C6H14O3P.In/c3*1-3-5-8-10(7)9-6-4-2;/h3*3-6H2,1-2H3;/q3*-1;+3
InChIKeyLWDIXTNCLFUVGJ-UHFFFAOYSA-N
XLogP3.90
TPSA124.56 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds18
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500610.27
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tris(dipropyl phosphite);indium(3+)?
The IUPAC name of tris(dipropyl phosphite);indium(3+) (CID 23460130) is tris(dipropyl phosphite);indium(3+).
What is the SMILES notation for tris(dipropyl phosphite);indium(3+)?
The canonical SMILES for tris(dipropyl phosphite);indium(3+) is CCCOP([O-])OCCC.CCCOP([O-])OCCC.CCCOP([O-])OCCC.[In+3].
What is the InChIKey of tris(dipropyl phosphite);indium(3+)?
The InChIKey is LWDIXTNCLFUVGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/3C6H14O3P.In/c3*1-3-5-8-10(7)9-6-4-2;/h3*3-6H2,1-2H3;/q3*-1;+3.
What are the key properties of tris(dipropyl phosphite);indium(3+)?
tris(dipropyl phosphite);indium(3+) has a molecular weight of 610.27 g/mol, XLogP of 3.90, 18 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for tris(dipropyl phosphite);indium(3+) is sourced from PubChem (CID 23460130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).