Structure Database (LMSD)
Common Name
pentadecanal
Systematic Name
pentadecanal
Synonyms
3D model of pentadecanal
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)
XGQJZNCFDLXSIJ-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C15H30O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h15H,2-14H2,1H3
SMILES (Click to copy)
C(CCCCC)CCCCCCCCC([H])=O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
16
Rings
0
Aromatic Rings
0
Rotatable Bonds
13
Van der Waals Molecular Volume
274.21
Topological Polar Surface Area
17.07
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
logP
5.28
Molar Refractivity
71.76
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Created at
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Updated at
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