Structure Database (LMSD)
Common Name
2-Methyl-2-pentenoic acid
Systematic Name
(2Z)-2-methylpent-2-enoic acid
Synonyms
3D model of 2-Methyl-2-pentenoic 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)
JJYWRQLLQAKNAD-PLNGDYQASA-N
InChi (Click to copy)
InChI=1S/C6H10O2/c1-3-4-5(2)6(7)8/h4H,3H2,1-2H3,(H,7,8)/b5-4-
SMILES (Click to copy)
CC/C=C(\C(O)=O)/C
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
8
Rings
0
Aromatic Rings
0
Rotatable Bonds
2
Van der Waals Molecular Volume
124.66
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
1.43
Molar Refractivity
31.68
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Created at
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Updated at
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