Structure Database (LMSD)
Common Name
4-Methyl-2-heptanol
Systematic Name
4-methylheptan-2-ol
Synonyms
3D model of 4-Methyl-2-heptanol
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
String Representations
InChiKey (Click to copy)
GUHWHNUGIGOSCN-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C8H18O/c1-4-5-7(2)6-8(3)9/h7-9H,4-6H2,1-3H3
SMILES (Click to copy)
CCCC(C)CC(C)O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
9
Rings
0
Aromatic Rings
0
Rotatable Bonds
4
Van der Waals Molecular Volume
155.75
Topological Polar Surface Area
20.23
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
1
logP
2.48
Molar Refractivity
40.88
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Created at
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Updated at
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