Structure Database (LMSD)

Common Name
2-methyl-7R,8S-Epoxy-octadecane
Systematic Name
2-methyl-7R,8S-Epoxy-octadecane
Synonyms
LM ID
LMFA12000282
Status
Active
Exact Mass
Calculate m/z
282.292265
Formula


Download as...
MDLMOL SDF CSV TSV
MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

Main

Classification

String Representations

InChiKey (Click to copy)
HFOFYNMWYRXIBP-RBUKOAKNSA-N
InChi (Click to copy)
InChI=1S/C19H38O/c1-4-5-6-7-8-9-10-11-15-18-19(20-18)16-13-12-14-17(2)3/h17-19H,4-16H2,1-3H3/t18-,19+/m0/s1
SMILES (Click to copy)
CC(C)CCCC[C@H]1O[C@H]1CCCCCCCCCC

References

Comments
Pherobase Semiochemicals

Other Databases

CHEBI ID
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 20
Rings 1
Aromatic Rings 0
Rotatable Bonds 14
Van der Waals Molecular Volume 333.69
Topological Polar Surface Area 12.53
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 1
logP 7.07
Molar Refractivity 90.22

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Created at
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Updated at
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