Structure Database (LMSD)
Common Name
(+)-28-methyl-triacontanoic acid
Systematic Name
(+)-28-methyl-triacontanoic acid
Synonyms
3D model of (+)-28-methyl-triacontanoic acid
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
OISCYPVRYCYZHI-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C31H62O2/c1-3-30(2)28-26-24-22-20-18-16-14-12-10-8-6-4-5-7-9-11-13-15-17-19-21-23-25-27-29-31(32)33/h30H,3-29H2,1-2H3,(H,32,33)
SMILES (Click to copy)
C(CCCCCCCCCCCCC(=O)O)CCCCCCCCCCCCCC(C)CC
References
Calculated Physicochemical Properties
Heavy Atoms
33
Rings
0
Aromatic Rings
0
Rotatable Bonds
28
Van der Waals Molecular Volume
559.80
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
11.26
Molar Refractivity
147.13
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Created at
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Updated at
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