(E)-1-[(E)-non-2-enoxy]non-2-ene

C18H34O — CID 6437569

IUPAC(E)-1-[(E)-non-2-enoxy]non-2-ene
SMILESCCCCCC/C=C/COC/C=C/CCCCCC
InChIInChI=1S/C18H34O/c1-3-5-7-9-11-13-15-17-19-18-16-14-12-10-8-6-4-2/h13-16H,3-12,17-18H2,1-2H3/b15-13+,16-14+
InChIKeyBRQPOXYJCYNNRQ-WXUKJITCSA-N
MW266.47 g/mol
LogP6.06
Rot. Bonds14

About (E)-1-[(E)-non-2-enoxy]non-2-ene

(E)-1-[(E)-non-2-enoxy]non-2-ene (PubChem CID 6437569) has the molecular formula C18H34O and a molecular weight of 266.47 g/mol. Its IUPAC name is (E)-1-[(E)-non-2-enoxy]non-2-ene.

Molecular Properties

Compound Name(E)-1-[(E)-non-2-enoxy]non-2-ene
PubChem CID6437569
Molecular FormulaC18H34O
Molecular Weight266.47 g/mol
Exact Mass266.26
IUPAC Name(E)-1-[(E)-non-2-enoxy]non-2-ene
SMILESCCCCCC/C=C/COC/C=C/CCCCCC
InChIInChI=1S/C18H34O/c1-3-5-7-9-11-13-15-17-19-18-16-14-12-10-8-6-4-2/h13-16H,3-12,17-18H2,1-2H3/b15-13+,16-14+
InChIKeyBRQPOXYJCYNNRQ-WXUKJITCSA-N
XLogP6.06
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.47
LogP ≤ 56.06
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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Related Compounds

CID 6441535
CID 6441535
CID 5362853
CID 5362853
CID 535026
CID 535026
CID 10616456
CID 10616456
CID 9979928
CID 9979928
CID 17915377
CID 17915377
CID 13033699
CID 13033699
CID 169265
CID 169265
CID 5358349
CID 5358349
CID 5362835
CID 5362835
CID 11286698
CID 11286698
CID 11332527
CID 11332527

Frequently Asked Questions

What is the IUPAC name of (E)-1-[(E)-non-2-enoxy]non-2-ene?
The IUPAC name of (E)-1-[(E)-non-2-enoxy]non-2-ene (CID 6437569) is (E)-1-[(E)-non-2-enoxy]non-2-ene.
What is the SMILES notation for (E)-1-[(E)-non-2-enoxy]non-2-ene?
The canonical SMILES for (E)-1-[(E)-non-2-enoxy]non-2-ene is CCCCCC/C=C/COC/C=C/CCCCCC.
What is the InChIKey of (E)-1-[(E)-non-2-enoxy]non-2-ene?
The InChIKey is BRQPOXYJCYNNRQ-WXUKJITCSA-N. The full InChI is InChI=1S/C18H34O/c1-3-5-7-9-11-13-15-17-19-18-16-14-12-10-8-6-4-2/h13-16H,3-12,17-18H2,1-2H3/b15-13+,16-14+.
What are the key properties of (E)-1-[(E)-non-2-enoxy]non-2-ene?
(E)-1-[(E)-non-2-enoxy]non-2-ene has a molecular weight of 266.47 g/mol, XLogP of 6.06, 14 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-[(E)-non-2-enoxy]non-2-ene is sourced from PubChem (CID 6437569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).