Structure Database (LMSD)
Common Name
Capraldehyde
Systematic Name
decanal
Synonyms
- Caprinaldehyde
3D model of Capraldehyde
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
String Representations
InChiKey (Click to copy)
KSMVZQYAVGTKIV-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C10H20O/c1-2-3-4-5-6-7-8-9-10-11/h10H,2-9H2,1H3
SMILES (Click to copy)
CCCCCCCCCC([H])=O
Other Databases
Wikipedia
KEGG ID
HMDB ID
CHEBI ID
PubChem CID
SwissLipids ID
PDB ID
Calculated Physicochemical Properties
Heavy Atoms
11
Rings
0
Aromatic Rings
0
Rotatable Bonds
8
Van der Waals Molecular Volume
187.71
Topological Polar Surface Area
17.07
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
logP
3.33
Molar Refractivity
48.67
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Updated at
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