acetaldehyde;dimethylalumane

C4H11AlO — CID 174605162

IUPACacetaldehyde;dimethylalumane
SMILESCC=O.C[AlH]C
InChIInChI=1S/C2H4O.2CH3.Al.H/c1-2-3;;;;/h2H,1H3;2*1H3;;
InChIKeyDFBSGQGJQSQIBS-UHFFFAOYSA-N
MW102.11 g/mol
LogP0.72
Rot. Bonds

About acetaldehyde;dimethylalumane

acetaldehyde;dimethylalumane (PubChem CID 174605162) has the molecular formula C4H11AlO and a molecular weight of 102.11 g/mol. Its IUPAC name is acetaldehyde;dimethylalumane.

Molecular Properties

Compound Nameacetaldehyde;dimethylalumane
PubChem CID174605162
Molecular FormulaC4H11AlO
Molecular Weight102.11 g/mol
Exact Mass102.06
IUPAC Nameacetaldehyde;dimethylalumane
SMILESCC=O.C[AlH]C
InChIInChI=1S/C2H4O.2CH3.Al.H/c1-2-3;;;;/h2H,1H3;2*1H3;;
InChIKeyDFBSGQGJQSQIBS-UHFFFAOYSA-N
XLogP0.72
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.11
LogP ≤ 50.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

acetaldehyde
CID 158130567
acetaldehyde;azane
CID 158638397
acetaldehyde;stibane
CID 173001465
acetaldehyde;germane
CID 173117793
acetaldehyde;gold
CID 173056569
acetaldehyde;bismuthane
CID 173068240
acetaldehyde;manganese
CID 172998417
dimethylalumane;formic acid
CID 174652827
acetaldehyde;ethane;methane
CID 159605506
potassium;acetaldehyde;chloride
CID 174943884
acetaldehyde;methanol
CID 19366238
strontium;acetaldehyde;hydride
CID 173047078

Frequently Asked Questions

What is the IUPAC name of acetaldehyde;dimethylalumane?
The IUPAC name of acetaldehyde;dimethylalumane (CID 174605162) is acetaldehyde;dimethylalumane.
What is the SMILES notation for acetaldehyde;dimethylalumane?
The canonical SMILES for acetaldehyde;dimethylalumane is CC=O.C[AlH]C.
What is the InChIKey of acetaldehyde;dimethylalumane?
The InChIKey is DFBSGQGJQSQIBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4O.2CH3.Al.H/c1-2-3;;;;/h2H,1H3;2*1H3;;.
What are the key properties of acetaldehyde;dimethylalumane?
acetaldehyde;dimethylalumane has a molecular weight of 102.11 g/mol, XLogP of 0.72, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for acetaldehyde;dimethylalumane is sourced from PubChem (CID 174605162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).