Structure database (LMSD)

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LM IDLMFA06000150
Common Name4,5-Dimethyldecanal
Systematic Name4,5-Dimethyldecanal
Synonyms-
Exact Mass
184.1827 (neutral)    Calculate m/z:
FormulaC12H24O
CategoryFatty Acyls [FA]
Main ClassFatty aldehydes [FA06]
Sub Class-
AbbrevFAL 12:0
PubChem CID44256570
InChIKeyWGMKSPMCYFDKHP-UHFFFAOYSA-N  Show lipids differing only in stereochemistry/bond geometry
InChI
InChI=1S/C12H24O/c1-4-5-6-8-11(2)12(3)9-7-10-13/h10-12H,4-9H2,1-3H3
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SMILES
C(CCC(C)C(C)CCCCC)(=O)[H]
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StatusActive
CommentsPherobase
Calculated physicochemical properties (?):
 Heavy Atoms13Rings0Aromatic Rings0Rotatable Bonds8
 van der Waals
Molecular Volume
222.31Topological Polar
Surface Area
17.07Hydrogen
Bond Donors
0Hydrogen
Bond Acceptors
1
 logP3.82Molar
Refractivity
57.77