ethoxyethane;titanium;trihydrochloride

C4H13Cl3OTi — CID 173160344

IUPACethoxyethane;titanium;trihydrochloride
SMILESCCOCC.Cl.Cl.Cl.[Ti]
InChIInChI=1S/C4H10O.3ClH.Ti/c1-3-5-4-2;;;;/h3-4H2,1-2H3;3*1H;
InChIKeyAZSOHFGSOXBDAY-UHFFFAOYSA-N
MW231.37 g/mol
LogP2.31
Rot. Bonds2

About ethoxyethane;titanium;trihydrochloride

ethoxyethane;titanium;trihydrochloride (PubChem CID 173160344) has the molecular formula C4H13Cl3OTi and a molecular weight of 231.37 g/mol. Its IUPAC name is ethoxyethane;titanium;trihydrochloride.

Molecular Properties

Compound Nameethoxyethane;titanium;trihydrochloride
PubChem CID173160344
Molecular FormulaC4H13Cl3OTi
Molecular Weight231.37 g/mol
Exact Mass229.95
IUPAC Nameethoxyethane;titanium;trihydrochloride
SMILESCCOCC.Cl.Cl.Cl.[Ti]
InChIInChI=1S/C4H10O.3ClH.Ti/c1-3-5-4-2;;;;/h3-4H2,1-2H3;3*1H;
InChIKeyAZSOHFGSOXBDAY-UHFFFAOYSA-N
XLogP2.31
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.37
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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ethoxyethane;sulfane
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ethoxyethane;sulfane
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ethoxyethane;pentahydrate
CID 141041283
disodium;ethoxyethane
CID 23107014
ethoxyethane;hydrate
CID 22594236
CID 88776884
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CID 135083812

Frequently Asked Questions

What is the IUPAC name of ethoxyethane;titanium;trihydrochloride?
The IUPAC name of ethoxyethane;titanium;trihydrochloride (CID 173160344) is ethoxyethane;titanium;trihydrochloride.
What is the SMILES notation for ethoxyethane;titanium;trihydrochloride?
The canonical SMILES for ethoxyethane;titanium;trihydrochloride is CCOCC.Cl.Cl.Cl.[Ti].
What is the InChIKey of ethoxyethane;titanium;trihydrochloride?
The InChIKey is AZSOHFGSOXBDAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O.3ClH.Ti/c1-3-5-4-2;;;;/h3-4H2,1-2H3;3*1H;.
What are the key properties of ethoxyethane;titanium;trihydrochloride?
ethoxyethane;titanium;trihydrochloride has a molecular weight of 231.37 g/mol, XLogP of 2.31, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxyethane;titanium;trihydrochloride is sourced from PubChem (CID 173160344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).