alumane;(Z)-4-hydroxypent-3-en-2-one;manganese

C5H11AlMnO2 — CID 173263428

IUPACalumane;(Z)-4-hydroxypent-3-en-2-one;manganese
SMILESCC(=O)/C=C(/C)O.[AlH3].[Mn]
InChIInChI=1S/C5H8O2.Al.Mn.3H/c1-4(6)3-5(2)7;;;;;/h3,6H,1-2H3;;;;;/b4-3-;;;;;
InChIKeyLNGZDTODYKPBEK-GLUPTGNJSA-N
MW185.06 g/mol
LogP-0.15
Rot. Bonds1

About alumane;(Z)-4-hydroxypent-3-en-2-one;manganese

alumane;(Z)-4-hydroxypent-3-en-2-one;manganese (PubChem CID 173263428) has the molecular formula C5H11AlMnO2 and a molecular weight of 185.06 g/mol. Its IUPAC name is alumane;(Z)-4-hydroxypent-3-en-2-one;manganese.

Molecular Properties

Compound Namealumane;(Z)-4-hydroxypent-3-en-2-one;manganese
PubChem CID173263428
Molecular FormulaC5H11AlMnO2
Molecular Weight185.06 g/mol
Exact Mass185.00
IUPAC Namealumane;(Z)-4-hydroxypent-3-en-2-one;manganese
SMILESCC(=O)/C=C(/C)O.[AlH3].[Mn]
InChIInChI=1S/C5H8O2.Al.Mn.3H/c1-4(6)3-5(2)7;;;;;/h3,6H,1-2H3;;;;;/b4-3-;;;;;
InChIKeyLNGZDTODYKPBEK-GLUPTGNJSA-N
XLogP-0.15
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.06
LogP ≤ 5-0.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

bis((Z)-4-hydroxypent-3-en-2-one);(E)-4-hydroxypent-3-en-2-one;manganese
CID 71311349
pentakis((Z)-4-hydroxypent-3-en-2-one);(E)-4-hydroxypent-3-en-2-one;iron
CID 176885193
europium;tris(4-hydroxypent-3-en-2-one)
CID 3566312
tris((Z)-4-hydroxypent-3-en-2-one);thulium
CID 131701275
tetrakis(4-hydroxypent-3-en-2-one);thorium
CID 50912505
hafnium;tetrakis((E)-4-hydroxypent-3-en-2-one)
CID 53393529
tris(4-hydroxypent-3-en-2-one);thulium
CID 175647568
hafnium;tetrakis((Z)-4-hydroxypent-3-en-2-one)
CID 11330624
tris((Z)-4-hydroxypent-3-en-2-one);ruthenium
CID 5364023
cobalt;tris((E)-4-hydroxypent-3-en-2-one)
CID 11100361
bis((Z)-4-hydroxypent-3-en-2-one);rhodium
CID 11358512
4-hydroxypent-3-en-2-one;titanium
CID 162678859

Frequently Asked Questions

What is the IUPAC name of alumane;(Z)-4-hydroxypent-3-en-2-one;manganese?
The IUPAC name of alumane;(Z)-4-hydroxypent-3-en-2-one;manganese (CID 173263428) is alumane;(Z)-4-hydroxypent-3-en-2-one;manganese.
What is the SMILES notation for alumane;(Z)-4-hydroxypent-3-en-2-one;manganese?
The canonical SMILES for alumane;(Z)-4-hydroxypent-3-en-2-one;manganese is CC(=O)/C=C(/C)O.[AlH3].[Mn].
What is the InChIKey of alumane;(Z)-4-hydroxypent-3-en-2-one;manganese?
The InChIKey is LNGZDTODYKPBEK-GLUPTGNJSA-N. The full InChI is InChI=1S/C5H8O2.Al.Mn.3H/c1-4(6)3-5(2)7;;;;;/h3,6H,1-2H3;;;;;/b4-3-;;;;;.
What are the key properties of alumane;(Z)-4-hydroxypent-3-en-2-one;manganese?
alumane;(Z)-4-hydroxypent-3-en-2-one;manganese has a molecular weight of 185.06 g/mol, XLogP of -0.15, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for alumane;(Z)-4-hydroxypent-3-en-2-one;manganese is sourced from PubChem (CID 173263428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).