dodec-1-ene;ethene

C18H36 — CID 158697165

IUPACdodec-1-ene;ethene
SMILESC=C.C=C.C=C.C=CCCCCCCCCCC
InChIInChI=1S/C12H24.3C2H4/c1-3-5-7-9-11-12-10-8-6-4-2;3*1-2/h3H,1,4-12H2,2H3;3*1-2H2
InChIKeyIHBZTURYWYFOGN-UHFFFAOYSA-N
MW252.49 g/mol
LogP7.11
Rot. Bonds9

About dodec-1-ene;ethene

dodec-1-ene;ethene (PubChem CID 158697165) has the molecular formula C18H36 and a molecular weight of 252.49 g/mol. Its IUPAC name is dodec-1-ene;ethene.

Molecular Properties

Compound Namedodec-1-ene;ethene
PubChem CID158697165
Molecular FormulaC18H36
Molecular Weight252.49 g/mol
Exact Mass252.28
IUPAC Namedodec-1-ene;ethene
SMILESC=C.C=C.C=C.C=CCCCCCCCCCC
InChIInChI=1S/C12H24.3C2H4/c1-3-5-7-9-11-12-10-8-6-4-2;3*1-2/h3H,1,4-12H2,2H3;3*1-2H2
InChIKeyIHBZTURYWYFOGN-UHFFFAOYSA-N
XLogP7.11
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500252.49
LogP ≤ 57.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

dec-1-ene;ethene
CID 161044144
octadecane;octadec-1-ene
CID 162018238
non-1-ene
CID 141296734
hexane;octadec-1-ene
CID 175577514
octadeca-1,17-diene;tetradec-1-ene
CID 173070986
octadec-1-ene;tetradec-1-ene
CID 158470925
dec-1-ene;dodec-1-ene;tetradec-1-ene
CID 159177706
oct-1-ene;hydrobromide
CID 88838560
oct-1-ene;tetrahydrochloride
CID 172847494
azane;oct-1-ene;stibane
CID 174580801
bismuthane;oct-1-ene;sulfane
CID 174601016
potassium;hydride;octadec-1-ene
CID 175063573

Frequently Asked Questions

What is the IUPAC name of dodec-1-ene;ethene?
The IUPAC name of dodec-1-ene;ethene (CID 158697165) is dodec-1-ene;ethene.
What is the SMILES notation for dodec-1-ene;ethene?
The canonical SMILES for dodec-1-ene;ethene is C=C.C=C.C=C.C=CCCCCCCCCCC.
What is the InChIKey of dodec-1-ene;ethene?
The InChIKey is IHBZTURYWYFOGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24.3C2H4/c1-3-5-7-9-11-12-10-8-6-4-2;3*1-2/h3H,1,4-12H2,2H3;3*1-2H2.
What are the key properties of dodec-1-ene;ethene?
dodec-1-ene;ethene has a molecular weight of 252.49 g/mol, XLogP of 7.11, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dodec-1-ene;ethene is sourced from PubChem (CID 158697165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).