Structure Database (LMSD)
Common Name
trans-3-Octen-2-ol
Systematic Name
(3E)-oct-3-en-2-ol
Synonyms
3D model of trans-3-Octen-2-ol
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
String Representations
InChiKey (Click to copy)
YJJIVDCKSZMHGZ-VOTSOKGWSA-N
InChi (Click to copy)
InChI=1S/C8H16O/c1-3-4-5-6-7-8(2)9/h6-9H,3-5H2,1-2H3/b7-6+
SMILES (Click to copy)
OC(C)/C=C/CCCC
References
Calculated Physicochemical Properties
Heavy Atoms
9
Rings
0
Aromatic Rings
0
Rotatable Bonds
4
Van der Waals Molecular Volume
153.11
Topological Polar Surface Area
20.23
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
1
logP
2.40
Molar Refractivity
40.86
Admin
Created at
-
Updated at
-