bis(propan-2-ol);titanium;hydrochloride

C6H17ClO2Ti — CID 87233898

IUPACbis(propan-2-ol);titanium;hydrochloride
SMILESCC(C)O.CC(C)O.Cl.[Ti]
InChIInChI=1S/2C3H8O.ClH.Ti/c2*1-3(2)4;;/h2*3-4H,1-2H3;1H;
InChIKeyKGAZHEYXXQDXQW-UHFFFAOYSA-N
MW204.52 g/mol
LogP1.19
Rot. Bonds

About bis(propan-2-ol);titanium;hydrochloride

bis(propan-2-ol);titanium;hydrochloride (PubChem CID 87233898) has the molecular formula C6H17ClO2Ti and a molecular weight of 204.52 g/mol. Its IUPAC name is bis(propan-2-ol);titanium;hydrochloride.

Molecular Properties

Compound Namebis(propan-2-ol);titanium;hydrochloride
PubChem CID87233898
Molecular FormulaC6H17ClO2Ti
Molecular Weight204.52 g/mol
Exact Mass204.04
IUPAC Namebis(propan-2-ol);titanium;hydrochloride
SMILESCC(C)O.CC(C)O.Cl.[Ti]
InChIInChI=1S/2C3H8O.ClH.Ti/c2*1-3(2)4;;/h2*3-4H,1-2H3;1H;
InChIKeyKGAZHEYXXQDXQW-UHFFFAOYSA-N
XLogP1.19
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.52
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

propan-2-ol;titanium
CID 25200171
propan-2-ol;titanium;hydroiodide
CID 175242007
azane;propan-2-ol;hydrochloride
CID 88500405
CID 175756453
CID 175756453
tris(propan-2-ol);titanium;hydrate
CID 22645817
propan-2-ol;dihydrate;trihydrochloride
CID 172856873
magnesium;hydride;propan-2-ol;hydrochloride
CID 173490258
propan-2-ol;vanadium;hydrate;dihydrochloride
CID 171375749
hypochlorous acid;bis(propan-2-ol);titanium
CID 88685410
aluminum propan-2-ol
CID 18462529
erbium;propan-2-ol
CID 160843836
CID 131857540
CID 131857540

Frequently Asked Questions

What is the IUPAC name of bis(propan-2-ol);titanium;hydrochloride?
The IUPAC name of bis(propan-2-ol);titanium;hydrochloride (CID 87233898) is bis(propan-2-ol);titanium;hydrochloride.
What is the SMILES notation for bis(propan-2-ol);titanium;hydrochloride?
The canonical SMILES for bis(propan-2-ol);titanium;hydrochloride is CC(C)O.CC(C)O.Cl.[Ti].
What is the InChIKey of bis(propan-2-ol);titanium;hydrochloride?
The InChIKey is KGAZHEYXXQDXQW-UHFFFAOYSA-N. The full InChI is InChI=1S/2C3H8O.ClH.Ti/c2*1-3(2)4;;/h2*3-4H,1-2H3;1H;.
What are the key properties of bis(propan-2-ol);titanium;hydrochloride?
bis(propan-2-ol);titanium;hydrochloride has a molecular weight of 204.52 g/mol, XLogP of 1.19, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(propan-2-ol);titanium;hydrochloride is sourced from PubChem (CID 87233898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).