2-hept-1-en-2-yloxyhept-1-ene

C14H26O — CID 23221782

IUPAC2-hept-1-en-2-yloxyhept-1-ene
SMILESC=C(CCCCC)OC(=C)CCCCC
InChIInChI=1S/C14H26O/c1-5-7-9-11-13(3)15-14(4)12-10-8-6-2/h3-12H2,1-2H3
InChIKeyLMYCLWZNCIKEPH-UHFFFAOYSA-N
MW210.36 g/mol
LogP5.19
Rot. Bonds10

About 2-hept-1-en-2-yloxyhept-1-ene

2-hept-1-en-2-yloxyhept-1-ene (PubChem CID 23221782) has the molecular formula C14H26O and a molecular weight of 210.36 g/mol. Its IUPAC name is 2-hept-1-en-2-yloxyhept-1-ene.

Molecular Properties

Compound Name2-hept-1-en-2-yloxyhept-1-ene
PubChem CID23221782
Molecular FormulaC14H26O
Molecular Weight210.36 g/mol
Exact Mass210.20
IUPAC Name2-hept-1-en-2-yloxyhept-1-ene
SMILESC=C(CCCCC)OC(=C)CCCCC
InChIInChI=1S/C14H26O/c1-5-7-9-11-13(3)15-14(4)12-10-8-6-2/h3-12H2,1-2H3
InChIKeyLMYCLWZNCIKEPH-UHFFFAOYSA-N
XLogP5.19
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500210.36
LogP ≤ 55.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-hept-1-en-2-yloxyhept-1-ene?
The IUPAC name of 2-hept-1-en-2-yloxyhept-1-ene (CID 23221782) is 2-hept-1-en-2-yloxyhept-1-ene.
What is the SMILES notation for 2-hept-1-en-2-yloxyhept-1-ene?
The canonical SMILES for 2-hept-1-en-2-yloxyhept-1-ene is C=C(CCCCC)OC(=C)CCCCC.
What is the InChIKey of 2-hept-1-en-2-yloxyhept-1-ene?
The InChIKey is LMYCLWZNCIKEPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O/c1-5-7-9-11-13(3)15-14(4)12-10-8-6-2/h3-12H2,1-2H3.
What are the key properties of 2-hept-1-en-2-yloxyhept-1-ene?
2-hept-1-en-2-yloxyhept-1-ene has a molecular weight of 210.36 g/mol, XLogP of 5.19, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hept-1-en-2-yloxyhept-1-ene is sourced from PubChem (CID 23221782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).