Structure Database (LMSD)

Common Name
Laurylaldehyde
Systematic Name
dodecanal
Synonyms
  • Lauric aldehyde
LM ID
LMFA06000071
Formula
Exact Mass
Calculate m/z
184.182715
Sum Composition
Status
Active


Classification

String Representations

InChiKey (Click to copy)
HFJRKMMYBMWEAD-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C12H24O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h12H,2-11H2,1H3
SMILES (Click to copy)
C(CC)CCCCCCCCC([H])=O

Other Databases

KEGG ID
HMDB ID
CHEBI ID
PubChem CID
SwissLipids ID

Calculated Physicochemical Properties

Heavy Atoms 13
Rings 0
Aromatic Rings 0
Rotatable Bonds 10
Van der Waals Molecular Volume 222.31
Topological Polar Surface Area 17.07
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 1
logP 4.11
Molar Refractivity 57.91

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Created at
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Updated at
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