2-bromoethanone;yttrium(3+)

C2H2BrOY+2 — CID 20756926

IUPAC2-bromoethanone;yttrium(3+)
SMILESO=[C-]CBr.[Y+3]
InChIInChI=1S/C2H2BrO.Y/c3-1-2-4;/h1H2;/q-1;+3
InChIKeyWARILRKRDQVRLI-UHFFFAOYSA-N
MW210.85 g/mol
LogP0.49
Rot. Bonds1

About 2-bromoethanone;yttrium(3+)

2-bromoethanone;yttrium(3+) (PubChem CID 20756926) has the molecular formula C2H2BrOY+2 and a molecular weight of 210.85 g/mol. Its IUPAC name is 2-bromoethanone;yttrium(3+).

Molecular Properties

Compound Name2-bromoethanone;yttrium(3+)
PubChem CID20756926
Molecular FormulaC2H2BrOY+2
Molecular Weight210.85 g/mol
Exact Mass209.83
IUPAC Name2-bromoethanone;yttrium(3+)
SMILESO=[C-]CBr.[Y+3]
InChIInChI=1S/C2H2BrO.Y/c3-1-2-4;/h1H2;/q-1;+3
InChIKeyWARILRKRDQVRLI-UHFFFAOYSA-N
XLogP0.49
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.85
LogP ≤ 50.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

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manganese;pentan-1-one
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carbanide;hydroxymethanone;pentane-1,5-dione;bis(yttrium)
CID 58219833
gold(1+);5-oxopentanal
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butan-1-one;carbanide;manganese;methanone;phosphane
CID 164671894
manganese;methanone;propan-1-one
CID 88800461
tetrasodium;3-[2-[bis(2-carboxylatoethyl)amino]ethyl-(3-oxopropyl)amino]propanoate;hydroxide
CID 154597232
2-isocyanoethanone
CID 102073221
CID 163837414
CID 163837414
hexane-1,5-dione;tungsten
CID 58974959
5-(dimethylamino)pentan-1-one;yttrium
CID 153365388

Frequently Asked Questions

What is the IUPAC name of 2-bromoethanone;yttrium(3+)?
The IUPAC name of 2-bromoethanone;yttrium(3+) (CID 20756926) is 2-bromoethanone;yttrium(3+).
What is the SMILES notation for 2-bromoethanone;yttrium(3+)?
The canonical SMILES for 2-bromoethanone;yttrium(3+) is O=[C-]CBr.[Y+3].
What is the InChIKey of 2-bromoethanone;yttrium(3+)?
The InChIKey is WARILRKRDQVRLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H2BrO.Y/c3-1-2-4;/h1H2;/q-1;+3.
What are the key properties of 2-bromoethanone;yttrium(3+)?
2-bromoethanone;yttrium(3+) has a molecular weight of 210.85 g/mol, XLogP of 0.49, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromoethanone;yttrium(3+) is sourced from PubChem (CID 20756926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).