Structure Database (LMSD)
Common Name
alpha-Terpinene
Systematic Name
Synonyms
3D model of alpha-Terpinene
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
Category
Main Class
Sub Class
Level 4 Class
String Representations
InChiKey (Click to copy)
YHQGMYUVUMAZJR-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,6,8H,5,7H2,1-3H3
SMILES (Click to copy)
C1(=CC=C(C)CC1)C(C)C
References
Calculated Physicochemical Properties
Heavy Atoms
10
Rings
1
Aromatic Rings
0
Rotatable Bonds
1
Van der Waals Molecular Volume
163.92
Topological Polar Surface Area
0.00
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
0
logP
3.31
Molar Refractivity
45.91
Admin
Created at
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Updated at
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