CCC=O
CAS: 123-38-6
Nom: propanal
SMILES: CCC=O

Molecular Processing

Molecular formula
C3H6O
Molecular weight
58.08
Exact mass
58.0419
XLogP
0.6
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
4
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
16.36

Supplementary Information

InChIKey: NBBJYMSMWIIQGU-UHFFFAOYSA-N
Synonymes
Propionaldehydepropanal123-38-6PropanaldehydePropylaldehydePropaldehydeMethylacetaldehyden-PropanalPropionalPropionic aldehyde1-PropanalPropylic aldehyden-PropionaldehydePropyl aldehydeAldehyde propionique1-PropanoneFEMA No. 2923FEMA Number 2923DTXSID2021658NCI-C61029AMJ2B4M67VNSC-6493DTXCID001658CHEBI:17153RefChem:6675204-623-0ProponalPropanalaldehydeProprionaldehydeNSC 6493
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Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→