(E)-dec-5-en-2,8-diyne

C10H12 — CID 13442496

IUPAC(E)-dec-5-en-2,8-diyne
SMILESCC#CC/C=C/CC#CC
InChIInChI=1S/C10H12/c1-3-5-7-9-10-8-6-4-2/h9-10H,7-8H2,1-2H3/b10-9+
InChIKeyYFRPSMCRNSOZLM-MDZDMXLPSA-N
MW132.21 g/mol
LogP2.37
Rot. Bonds2

About (E)-dec-5-en-2,8-diyne

(E)-dec-5-en-2,8-diyne (PubChem CID 13442496) has the molecular formula C10H12 and a molecular weight of 132.21 g/mol. Its IUPAC name is (E)-dec-5-en-2,8-diyne.

Molecular Properties

Compound Name(E)-dec-5-en-2,8-diyne
PubChem CID13442496
Molecular FormulaC10H12
Molecular Weight132.21 g/mol
Exact Mass132.09
IUPAC Name(E)-dec-5-en-2,8-diyne
SMILESCC#CC/C=C/CC#CC
InChIInChI=1S/C10H12/c1-3-5-7-9-10-8-6-4-2/h9-10H,7-8H2,1-2H3/b10-9+
InChIKeyYFRPSMCRNSOZLM-MDZDMXLPSA-N
XLogP2.37
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.21
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (E)-dec-5-en-2,8-diyne?
The IUPAC name of (E)-dec-5-en-2,8-diyne (CID 13442496) is (E)-dec-5-en-2,8-diyne.
What is the SMILES notation for (E)-dec-5-en-2,8-diyne?
The canonical SMILES for (E)-dec-5-en-2,8-diyne is CC#CC/C=C/CC#CC.
What is the InChIKey of (E)-dec-5-en-2,8-diyne?
The InChIKey is YFRPSMCRNSOZLM-MDZDMXLPSA-N. The full InChI is InChI=1S/C10H12/c1-3-5-7-9-10-8-6-4-2/h9-10H,7-8H2,1-2H3/b10-9+.
What are the key properties of (E)-dec-5-en-2,8-diyne?
(E)-dec-5-en-2,8-diyne has a molecular weight of 132.21 g/mol, XLogP of 2.37, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-dec-5-en-2,8-diyne is sourced from PubChem (CID 13442496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).