1-hept-1-enoxyhept-1-ene

C14H26O — CID 54375697

IUPAC1-hept-1-enoxyhept-1-ene
SMILESCCCCCC=COC=CCCCCC
InChIInChI=1S/C14H26O/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2/h11-14H,3-10H2,1-2H3
InChIKeyUWIOZIBLWQOLOP-UHFFFAOYSA-N
MW210.36 g/mol
LogP5.19
Rot. Bonds10

About 1-hept-1-enoxyhept-1-ene

1-hept-1-enoxyhept-1-ene (PubChem CID 54375697) has the molecular formula C14H26O and a molecular weight of 210.36 g/mol. Its IUPAC name is 1-hept-1-enoxyhept-1-ene.

Molecular Properties

Compound Name1-hept-1-enoxyhept-1-ene
PubChem CID54375697
Molecular FormulaC14H26O
Molecular Weight210.36 g/mol
Exact Mass210.20
IUPAC Name1-hept-1-enoxyhept-1-ene
SMILESCCCCCC=COC=CCCCCC
InChIInChI=1S/C14H26O/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2/h11-14H,3-10H2,1-2H3
InChIKeyUWIOZIBLWQOLOP-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 1-hept-1-enoxyhept-1-ene?
The IUPAC name of 1-hept-1-enoxyhept-1-ene (CID 54375697) is 1-hept-1-enoxyhept-1-ene.
What is the SMILES notation for 1-hept-1-enoxyhept-1-ene?
The canonical SMILES for 1-hept-1-enoxyhept-1-ene is CCCCCC=COC=CCCCCC.
What is the InChIKey of 1-hept-1-enoxyhept-1-ene?
The InChIKey is UWIOZIBLWQOLOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2/h11-14H,3-10H2,1-2H3.
What are the key properties of 1-hept-1-enoxyhept-1-ene?
1-hept-1-enoxyhept-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 1-hept-1-enoxyhept-1-ene is sourced from PubChem (CID 54375697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).