Structure Database (LMSD)
Common Name
2,4-dimethyl-2E-tetradecenoic acid
Systematic Name
2,4-dimethyl-2E-tetradecenoic acid
Synonyms
3D model of 2,4-dimethyl-2E-tetradecenoic acid
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
NPIJNQJBRSVMRD-FYWRMAATSA-N
InChi (Click to copy)
InChI=1S/C16H30O2/c1-4-5-6-7-8-9-10-11-12-14(2)13-15(3)16(17)18/h13-14H,4-12H2,1-3H3,(H,17,18)/b15-13+
SMILES (Click to copy)
C(CCCC)CCCCCC(C)/C=C(\C)/C(=O)O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
18
Rings
0
Aromatic Rings
0
Rotatable Bonds
11
Van der Waals Molecular Volume
297.66
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
5.18
Molar Refractivity
77.78
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Created at
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Updated at
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