azanium;titanium;acetate

C2H7NO2Ti — CID 173299620

IUPACazanium;titanium;acetate
SMILESCC(=O)[O-].[NH4+].[Ti]
InChIInChI=1S/C2H4O2.H3N.Ti/c1-2(3)4;;/h1H3,(H,3,4);1H3;
InChIKeyLXOTWUWSLPPPPL-UHFFFAOYSA-N
MW124.95 g/mol
LogP-0.87
Rot. Bonds

About azanium;titanium;acetate

azanium;titanium;acetate (PubChem CID 173299620) has the molecular formula C2H7NO2Ti and a molecular weight of 124.95 g/mol. Its IUPAC name is azanium;titanium;acetate.

Molecular Properties

Compound Nameazanium;titanium;acetate
PubChem CID173299620
Molecular FormulaC2H7NO2Ti
Molecular Weight124.95 g/mol
Exact Mass125.00
IUPAC Nameazanium;titanium;acetate
SMILESCC(=O)[O-].[NH4+].[Ti]
InChIInChI=1S/C2H4O2.H3N.Ti/c1-2(3)4;;/h1H3,(H,3,4);1H3;
InChIKeyLXOTWUWSLPPPPL-UHFFFAOYSA-N
XLogP-0.87
TPSA76.63 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.95
LogP ≤ 5-0.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

azanium;cerium(4+);pentaacetate
CID 172759983
azanium;nickel;acetate;hydroxide
CID 174923833
uranium hexaacetate
CID 20541057
zirconium acetate
CID 18596
terbium(3+) acetate
CID 22482914
(indium(3+)) diacetate
CID 173450278
tricalcium diacetate
CID 19804487
manganese(3+) diacetate
CID 159209977
bis(cobalt(2+));tetraacetate
CID 157121376
CID 170997571
CID 170997571
nonasodium;nonaacetate
CID 173443222
tris(barium(2+)) diacetate
CID 19804496

Frequently Asked Questions

What is the IUPAC name of azanium;titanium;acetate?
The IUPAC name of azanium;titanium;acetate (CID 173299620) is azanium;titanium;acetate.
What is the SMILES notation for azanium;titanium;acetate?
The canonical SMILES for azanium;titanium;acetate is CC(=O)[O-].[NH4+].[Ti].
What is the InChIKey of azanium;titanium;acetate?
The InChIKey is LXOTWUWSLPPPPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4O2.H3N.Ti/c1-2(3)4;;/h1H3,(H,3,4);1H3;.
What are the key properties of azanium;titanium;acetate?
azanium;titanium;acetate has a molecular weight of 124.95 g/mol, XLogP of -0.87, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azanium;titanium;acetate is sourced from PubChem (CID 173299620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).