2-(1-propan-2-yloxyethoxy)propane;titanium

C8H18O2Ti — CID 174925099

IUPAC2-(1-propan-2-yloxyethoxy)propane;titanium
SMILESCC(C)OC(C)OC(C)C.[Ti]
InChIInChI=1S/C8H18O2.Ti/c1-6(2)9-8(5)10-7(3)4;/h6-8H,1-5H3;
InChIKeyPMOMCTXXJFEJBA-UHFFFAOYSA-N
MW194.10 g/mol
LogP2.18
Rot. Bonds4

About 2-(1-propan-2-yloxyethoxy)propane;titanium

2-(1-propan-2-yloxyethoxy)propane;titanium (PubChem CID 174925099) has the molecular formula C8H18O2Ti and a molecular weight of 194.10 g/mol. Its IUPAC name is 2-(1-propan-2-yloxyethoxy)propane;titanium.

Molecular Properties

Compound Name2-(1-propan-2-yloxyethoxy)propane;titanium
PubChem CID174925099
Molecular FormulaC8H18O2Ti
Molecular Weight194.10 g/mol
Exact Mass194.08
IUPAC Name2-(1-propan-2-yloxyethoxy)propane;titanium
SMILESCC(C)OC(C)OC(C)C.[Ti]
InChIInChI=1S/C8H18O2.Ti/c1-6(2)9-8(5)10-7(3)4;/h6-8H,1-5H3;
InChIKeyPMOMCTXXJFEJBA-UHFFFAOYSA-N
XLogP2.18
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.10
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-[1-[di(propan-2-yloxy)methoxy]ethoxy-propan-2-yloxymethoxy]propane
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1-[1-(1-propan-2-yloxyethoxy)ethyl]piperidine
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CID 57100854
azane;methanol;2-propan-2-yloxypropane;hydrate
CID 173089924
CID 18764351
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methanol;propan-2-ol;2-propan-2-yloxypropane
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(3R)-2-methyl-3-propan-2-yloxybutane
CID 40522025
CID 22593281
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1-propan-2-yloxyethylsilane
CID 123194155
1-propan-2-yloxyethoxycycloundecane
CID 21496393
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CID 158018053

Frequently Asked Questions

What is the IUPAC name of 2-(1-propan-2-yloxyethoxy)propane;titanium?
The IUPAC name of 2-(1-propan-2-yloxyethoxy)propane;titanium (CID 174925099) is 2-(1-propan-2-yloxyethoxy)propane;titanium.
What is the SMILES notation for 2-(1-propan-2-yloxyethoxy)propane;titanium?
The canonical SMILES for 2-(1-propan-2-yloxyethoxy)propane;titanium is CC(C)OC(C)OC(C)C.[Ti].
What is the InChIKey of 2-(1-propan-2-yloxyethoxy)propane;titanium?
The InChIKey is PMOMCTXXJFEJBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O2.Ti/c1-6(2)9-8(5)10-7(3)4;/h6-8H,1-5H3;.
What are the key properties of 2-(1-propan-2-yloxyethoxy)propane;titanium?
2-(1-propan-2-yloxyethoxy)propane;titanium has a molecular weight of 194.10 g/mol, XLogP of 2.18, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-propan-2-yloxyethoxy)propane;titanium is sourced from PubChem (CID 174925099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).