3-ethenyl-6-(4-ethenylhex-5-enoxy)hex-1-ene

C16H26O — CID 57023807

IUPAC3-ethenyl-6-(4-ethenylhex-5-enoxy)hex-1-ene
SMILESC=CC(C=C)CCCOCCCC(C=C)C=C
InChIInChI=1S/C16H26O/c1-5-15(6-2)11-9-13-17-14-10-12-16(7-3)8-4/h5-8,15-16H,1-4,9-14H2
InChIKeyHFENHVOXCCHVNV-UHFFFAOYSA-N
MW234.38 g/mol
LogP4.54
Rot. Bonds12

About 3-ethenyl-6-(4-ethenylhex-5-enoxy)hex-1-ene

3-ethenyl-6-(4-ethenylhex-5-enoxy)hex-1-ene (PubChem CID 57023807) has the molecular formula C16H26O and a molecular weight of 234.38 g/mol. Its IUPAC name is 3-ethenyl-6-(4-ethenylhex-5-enoxy)hex-1-ene.

Molecular Properties

Compound Name3-ethenyl-6-(4-ethenylhex-5-enoxy)hex-1-ene
PubChem CID57023807
Molecular FormulaC16H26O
Molecular Weight234.38 g/mol
Exact Mass234.20
IUPAC Name3-ethenyl-6-(4-ethenylhex-5-enoxy)hex-1-ene
SMILESC=CC(C=C)CCCOCCCC(C=C)C=C
InChIInChI=1S/C16H26O/c1-5-15(6-2)11-9-13-17-14-10-12-16(7-3)8-4/h5-8,15-16H,1-4,9-14H2
InChIKeyHFENHVOXCCHVNV-UHFFFAOYSA-N
XLogP4.54
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.38
LogP ≤ 54.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-ethenyl-6-(4-ethenylhex-5-enoxy)hex-1-ene?
The IUPAC name of 3-ethenyl-6-(4-ethenylhex-5-enoxy)hex-1-ene (CID 57023807) is 3-ethenyl-6-(4-ethenylhex-5-enoxy)hex-1-ene.
What is the SMILES notation for 3-ethenyl-6-(4-ethenylhex-5-enoxy)hex-1-ene?
The canonical SMILES for 3-ethenyl-6-(4-ethenylhex-5-enoxy)hex-1-ene is C=CC(C=C)CCCOCCCC(C=C)C=C.
What is the InChIKey of 3-ethenyl-6-(4-ethenylhex-5-enoxy)hex-1-ene?
The InChIKey is HFENHVOXCCHVNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26O/c1-5-15(6-2)11-9-13-17-14-10-12-16(7-3)8-4/h5-8,15-16H,1-4,9-14H2.
What are the key properties of 3-ethenyl-6-(4-ethenylhex-5-enoxy)hex-1-ene?
3-ethenyl-6-(4-ethenylhex-5-enoxy)hex-1-ene has a molecular weight of 234.38 g/mol, XLogP of 4.54, 12 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenyl-6-(4-ethenylhex-5-enoxy)hex-1-ene is sourced from PubChem (CID 57023807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).