Structure Database (LMSD)
Common Name
19-methyl-7Z-eicosenoic acid
Systematic Name
19-methyl-7Z-eicosenoic acid
Synonyms
- delta7-i-21:1
3D model of 19-methyl-7Z-eicosenoic 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
References
String Representations
InChiKey (Click to copy)
WWLXQPINWFUSJJ-CLFYSBASSA-N
InChi (Click to copy)
InChI=1S/C21H40O2/c1-20(2)18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19-21(22)23/h7,9,20H,3-6,8,10-19H2,1-2H3,(H,22,23)/b9-7-
SMILES (Click to copy)
C(CCCCC/C=C\CCCCCCCCCCC(C)C)(=O)O
Other Databases
PubChem CID
Calculated Physicochemical Properties
Heavy Atoms
23
Rings
0
Aromatic Rings
0
Rotatable Bonds
17
Van der Waals Molecular Volume
384.16
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
7.13
Molar Refractivity
100.87
Admin
Created at
22nd Oct 2019
Updated at
22nd Oct 2019