neodymium(3+);tris(propan-2-olate)

C9H21NdO3 — CID 2734134

IUPACneodymium(3+);tris(propan-2-olate)
SMILESCC(C)[O-].CC(C)[O-].CC(C)[O-].[Nd+3]
InChIInChI=1S/3C3H7O.Nd/c3*1-3(2)4;/h3*3H,1-2H3;/q3*-1;+3
InChIKeyHZHUIQPXRWTHNF-UHFFFAOYSA-N
MW321.50 g/mol
LogP-0.73
Rot. Bonds

About neodymium(3+);tris(propan-2-olate)

neodymium(3+);tris(propan-2-olate) (PubChem CID 2734134) has the molecular formula C9H21NdO3 and a molecular weight of 321.50 g/mol. Its IUPAC name is neodymium(3+);tris(propan-2-olate).

Molecular Properties

Compound Nameneodymium(3+);tris(propan-2-olate)
PubChem CID2734134
Molecular FormulaC9H21NdO3
Molecular Weight321.50 g/mol
Exact Mass319.06
IUPAC Nameneodymium(3+);tris(propan-2-olate)
SMILESCC(C)[O-].CC(C)[O-].CC(C)[O-].[Nd+3]
InChIInChI=1S/3C3H7O.Nd/c3*1-3(2)4;/h3*3H,1-2H3;/q3*-1;+3
InChIKeyHZHUIQPXRWTHNF-UHFFFAOYSA-N
XLogP-0.73
TPSA69.18 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.50
LogP ≤ 5-0.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Aluminum isopropoxide
CID 11143
Triisopropyl borate
CID 21531
Aluminum sec-butoxide
CID 61289
Titanium isopropoxide
CID 11026
Antimony(3+) tripropan-2-olate
CID 3034303
Chlorotitanium triisopropoxide
CID 3084342
2-Butanol peroxide
CID 162258
Lanthanum isopropoxide
CID 9858075
Tellurium(IV) isopropoxide
CID 15771447
Germanium(IV) isopropoxide
CID 16685043
Zirconium(4+) propan-2-olate
CID 3083750
Tin(iv)isopropoxide
CID 71317417

Frequently Asked Questions

What is the IUPAC name of neodymium(3+);tris(propan-2-olate)?
The IUPAC name of neodymium(3+);tris(propan-2-olate) (CID 2734134) is neodymium(3+);tris(propan-2-olate).
What is the SMILES notation for neodymium(3+);tris(propan-2-olate)?
The canonical SMILES for neodymium(3+);tris(propan-2-olate) is CC(C)[O-].CC(C)[O-].CC(C)[O-].[Nd+3].
What is the InChIKey of neodymium(3+);tris(propan-2-olate)?
The InChIKey is HZHUIQPXRWTHNF-UHFFFAOYSA-N. The full InChI is InChI=1S/3C3H7O.Nd/c3*1-3(2)4;/h3*3H,1-2H3;/q3*-1;+3.
What are the key properties of neodymium(3+);tris(propan-2-olate)?
neodymium(3+);tris(propan-2-olate) has a molecular weight of 321.50 g/mol, XLogP of -0.73, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for neodymium(3+);tris(propan-2-olate) is sourced from PubChem (CID 2734134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).