Structure Database (LMSD)
Common Name
4,14-dimethyl-heptadecanoic acid
Systematic Name
4,14-dimethyl-heptadecanoic acid
Synonyms
3D model of 4,14-dimethyl-heptadecanoic 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)
QZEMXPHXFNUFBC-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C19H38O2/c1-4-12-17(2)13-10-8-6-5-7-9-11-14-18(3)15-16-19(20)21/h17-18H,4-16H2,1-3H3,(H,20,21)
SMILES (Click to copy)
C(CCCC(C)CCC)CCCCCC(C)CCC(=O)O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
21
Rings
0
Aromatic Rings
0
Rotatable Bonds
15
Van der Waals Molecular Volume
352.20
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
6.43
Molar Refractivity
91.66
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Created at
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Updated at
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