2-hydroxyacetyl chloride;titanium

C2H3ClO2Ti — CID 87281503

IUPAC2-hydroxyacetyl chloride;titanium
SMILESO=C(Cl)CO.[Ti]
InChIInChI=1S/C2H3ClO2.Ti/c3-2(5)1-4;/h4H,1H2;
InChIKeyHGCLZPAIXMKYJQ-UHFFFAOYSA-N
MW142.36 g/mol
LogP-0.26
Rot. Bonds1

About 2-hydroxyacetyl chloride;titanium

2-hydroxyacetyl chloride;titanium (PubChem CID 87281503) has the molecular formula C2H3ClO2Ti and a molecular weight of 142.36 g/mol. Its IUPAC name is 2-hydroxyacetyl chloride;titanium.

Molecular Properties

Compound Name2-hydroxyacetyl chloride;titanium
PubChem CID87281503
Molecular FormulaC2H3ClO2Ti
Molecular Weight142.36 g/mol
Exact Mass141.93
IUPAC Name2-hydroxyacetyl chloride;titanium
SMILESO=C(Cl)CO.[Ti]
InChIInChI=1S/C2H3ClO2.Ti/c3-2(5)1-4;/h4H,1H2;
InChIKeyHGCLZPAIXMKYJQ-UHFFFAOYSA-N
XLogP-0.26
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.36
LogP ≤ 5-0.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acid_halide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxyacetyl chloride;titanium?
The IUPAC name of 2-hydroxyacetyl chloride;titanium (CID 87281503) is 2-hydroxyacetyl chloride;titanium.
What is the SMILES notation for 2-hydroxyacetyl chloride;titanium?
The canonical SMILES for 2-hydroxyacetyl chloride;titanium is O=C(Cl)CO.[Ti].
What is the InChIKey of 2-hydroxyacetyl chloride;titanium?
The InChIKey is HGCLZPAIXMKYJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H3ClO2.Ti/c3-2(5)1-4;/h4H,1H2;.
What are the key properties of 2-hydroxyacetyl chloride;titanium?
2-hydroxyacetyl chloride;titanium has a molecular weight of 142.36 g/mol, XLogP of -0.26, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyacetyl chloride;titanium is sourced from PubChem (CID 87281503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).