Structure Database (LMSD)
Common Name
beta-himachalene
Systematic Name
(6xi)-himachal-1(11),4-diene 3,5,5,9-tetramethyl-2,4a,5,6,7,8-hexahydro-1H-benzo[7]annulene
Synonyms
3D model of beta-himachalene
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)
LCOSCMLXPAQCLQ-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C15H24/c1-11-7-8-13-12(2)6-5-9-15(3,4)14(13)10-11/h10,14H,5-9H2,1-4H3
SMILES (Click to copy)
C12C(=C(C)CCCC1(C)C)CCC(C)=C2
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
15
Rings
2
Aromatic Rings
0
Rotatable Bonds
0
Van der Waals Molecular Volume
238.06
Topological Polar Surface Area
0.00
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
0
logP
4.87
Molar Refractivity
66.81
Admin
Created at
-
Updated at
-