Structure Database (LMSD)
Common Name
(+)-sabinone
Systematic Name
(1S,5S)-4-methylidene-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-one
Synonyms
- (+)-Sabinone
- (+)-sabinone
3D model of (+)-sabinone
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
Level 4 Class
String Representations
InChiKey (Click to copy)
PBLWMCQDAGOTPV-SCZZXKLOSA-N
InChi (Click to copy)
InChI=1S/C10H14O/c1-6(2)10-4-8(10)7(3)9(11)5-10/h6,8H,3-5H2,1-2H3/t8-,10+/m1/s1
SMILES (Click to copy)
[C@]12(C(C)C)[C@H](C1)C(=C)C(=O)C2
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
11
Rings
2
Aromatic Rings
0
Rotatable Bonds
1
Van der Waals Molecular Volume
160.35
Topological Polar Surface Area
17.07
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
logP
2.18
Molar Refractivity
44.14
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Created at
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Updated at
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