propan-2-ol;titanium(4+);tetrachloride

C3H8Cl4OTi — CID 157071877

IUPACpropan-2-ol;titanium(4+);tetrachloride
SMILESCC(C)O.[Cl-].[Cl-].[Cl-].[Cl-].[Ti+4]
InChIInChI=1S/C3H8O.4ClH.Ti/c1-3(2)4;;;;;/h3-4H,1-2H3;4*1H;/q;;;;;+4/p-4
InChIKeyACNICLZFNJWNBW-UHFFFAOYSA-J
MW249.78 g/mol
LogP-11.60
Rot. Bonds

About propan-2-ol;titanium(4+);tetrachloride

propan-2-ol;titanium(4+);tetrachloride (PubChem CID 157071877) has the molecular formula C3H8Cl4OTi and a molecular weight of 249.78 g/mol. Its IUPAC name is propan-2-ol;titanium(4+);tetrachloride.

Molecular Properties

Compound Namepropan-2-ol;titanium(4+);tetrachloride
PubChem CID157071877
Molecular FormulaC3H8Cl4OTi
Molecular Weight249.78 g/mol
Exact Mass247.88
IUPAC Namepropan-2-ol;titanium(4+);tetrachloride
SMILESCC(C)O.[Cl-].[Cl-].[Cl-].[Cl-].[Ti+4]
InChIInChI=1S/C3H8O.4ClH.Ti/c1-3(2)4;;;;;/h3-4H,1-2H3;4*1H;/q;;;;;+4/p-4
InChIKeyACNICLZFNJWNBW-UHFFFAOYSA-J
XLogP-11.60
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.78
LogP ≤ 5-11.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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erbium;propan-2-ol
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tetrakis(propan-2-ol);samarium
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CID 131857540
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propan-2-ol;titanium
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niobium;tris(propan-2-ol)
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Frequently Asked Questions

What is the IUPAC name of propan-2-ol;titanium(4+);tetrachloride?
The IUPAC name of propan-2-ol;titanium(4+);tetrachloride (CID 157071877) is propan-2-ol;titanium(4+);tetrachloride.
What is the SMILES notation for propan-2-ol;titanium(4+);tetrachloride?
The canonical SMILES for propan-2-ol;titanium(4+);tetrachloride is CC(C)O.[Cl-].[Cl-].[Cl-].[Cl-].[Ti+4].
What is the InChIKey of propan-2-ol;titanium(4+);tetrachloride?
The InChIKey is ACNICLZFNJWNBW-UHFFFAOYSA-J. The full InChI is InChI=1S/C3H8O.4ClH.Ti/c1-3(2)4;;;;;/h3-4H,1-2H3;4*1H;/q;;;;;+4/p-4.
What are the key properties of propan-2-ol;titanium(4+);tetrachloride?
propan-2-ol;titanium(4+);tetrachloride has a molecular weight of 249.78 g/mol, XLogP of -11.60, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-ol;titanium(4+);tetrachloride is sourced from PubChem (CID 157071877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).