sodium;pentakis(propan-2-olate);titanium(4+)

C15H35NaO5Ti — CID 15772239

IUPACsodium;pentakis(propan-2-olate);titanium(4+)
SMILESCC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].[Na+].[Ti+4]
InChIInChI=1S/5C3H7O.Na.Ti/c5*1-3(2)4;;/h5*3H,1-2H3;;/q5*-1;+1;+4
InChIKeyHDADLOOISJDQNB-UHFFFAOYSA-N
MW366.30 g/mol
LogP-4.22
Rot. Bonds

About sodium;pentakis(propan-2-olate);titanium(4+)

sodium;pentakis(propan-2-olate);titanium(4+) (PubChem CID 15772239) has the molecular formula C15H35NaO5Ti and a molecular weight of 366.30 g/mol. Its IUPAC name is sodium;pentakis(propan-2-olate);titanium(4+).

Molecular Properties

Compound Namesodium;pentakis(propan-2-olate);titanium(4+)
PubChem CID15772239
Molecular FormulaC15H35NaO5Ti
Molecular Weight366.30 g/mol
Exact Mass366.19
IUPAC Namesodium;pentakis(propan-2-olate);titanium(4+)
SMILESCC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].[Na+].[Ti+4]
InChIInChI=1S/5C3H7O.Na.Ti/c5*1-3(2)4;;/h5*3H,1-2H3;;/q5*-1;+1;+4
InChIKeyHDADLOOISJDQNB-UHFFFAOYSA-N
XLogP-4.22
TPSA115.30 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.30
LogP ≤ 5-4.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

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propan-2-olate;titanium(4+);triiodide
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CID 91971223
molybdenum;hexakis(propan-2-olate)
CID 138991740
pentakis(europium(3+));oxygen(2-);tridecakis(propan-2-olate)
CID 139133025
CID 173069963
CID 173069963
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Frequently Asked Questions

What is the IUPAC name of sodium;pentakis(propan-2-olate);titanium(4+)?
The IUPAC name of sodium;pentakis(propan-2-olate);titanium(4+) (CID 15772239) is sodium;pentakis(propan-2-olate);titanium(4+).
What is the SMILES notation for sodium;pentakis(propan-2-olate);titanium(4+)?
The canonical SMILES for sodium;pentakis(propan-2-olate);titanium(4+) is CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].[Na+].[Ti+4].
What is the InChIKey of sodium;pentakis(propan-2-olate);titanium(4+)?
The InChIKey is HDADLOOISJDQNB-UHFFFAOYSA-N. The full InChI is InChI=1S/5C3H7O.Na.Ti/c5*1-3(2)4;;/h5*3H,1-2H3;;/q5*-1;+1;+4.
What are the key properties of sodium;pentakis(propan-2-olate);titanium(4+)?
sodium;pentakis(propan-2-olate);titanium(4+) has a molecular weight of 366.30 g/mol, XLogP of -4.22, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;pentakis(propan-2-olate);titanium(4+) is sourced from PubChem (CID 15772239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).