Structure Database (LMSD)
Common Name
2-Methylenebutan-1-ol
Systematic Name
2-Methylenebutan-1-ol
Synonyms
3D model of 2-Methylenebutan-1-ol
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
References
Comments
Pherobase
String Representations
InChiKey (Click to copy)
JKLUVCHKXQJGIG-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C5H10O/c1-3-5(2)4-6/h6H,2-4H2,1H3
SMILES (Click to copy)
OCC(=C)CC
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
6
Rings
0
Aromatic Rings
0
Rotatable Bonds
2
Van der Waals Molecular Volume
101.21
Topological Polar Surface Area
20.23
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
1
logP
1.23
Molar Refractivity
27.01
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Created at
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Updated at
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