2-methoxyacetic acid;titanium

C3H6O3Ti — CID 174298740

IUPAC2-methoxyacetic acid;titanium
SMILESCOCC(=O)O.[Ti]
InChIInChI=1S/C3H6O3.Ti/c1-6-2-3(4)5;/h2H2,1H3,(H,4,5);
InChIKeyFZUCRUJIJQACEL-UHFFFAOYSA-N
MW137.94 g/mol
LogP-0.29
Rot. Bonds2

About 2-methoxyacetic acid;titanium

2-methoxyacetic acid;titanium (PubChem CID 174298740) has the molecular formula C3H6O3Ti and a molecular weight of 137.94 g/mol. Its IUPAC name is 2-methoxyacetic acid;titanium.

Molecular Properties

Compound Name2-methoxyacetic acid;titanium
PubChem CID174298740
Molecular FormulaC3H6O3Ti
Molecular Weight137.94 g/mol
Exact Mass137.98
IUPAC Name2-methoxyacetic acid;titanium
SMILESCOCC(=O)O.[Ti]
InChIInChI=1S/C3H6O3.Ti/c1-6-2-3(4)5;/h2H2,1H3,(H,4,5);
InChIKeyFZUCRUJIJQACEL-UHFFFAOYSA-N
XLogP-0.29
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.94
LogP ≤ 5-0.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methoxyacetic acid;titanium?
The IUPAC name of 2-methoxyacetic acid;titanium (CID 174298740) is 2-methoxyacetic acid;titanium.
What is the SMILES notation for 2-methoxyacetic acid;titanium?
The canonical SMILES for 2-methoxyacetic acid;titanium is COCC(=O)O.[Ti].
What is the InChIKey of 2-methoxyacetic acid;titanium?
The InChIKey is FZUCRUJIJQACEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6O3.Ti/c1-6-2-3(4)5;/h2H2,1H3,(H,4,5);.
What are the key properties of 2-methoxyacetic acid;titanium?
2-methoxyacetic acid;titanium has a molecular weight of 137.94 g/mol, XLogP of -0.29, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxyacetic acid;titanium is sourced from PubChem (CID 174298740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).