(E)-dec-5-en-1-yne

C10H16 — CID 6437054

IUPAC(E)-dec-5-en-1-yne
SMILESC#CCC/C=C/CCCC
InChIInChI=1S/C10H16/c1-3-5-7-9-10-8-6-4-2/h1,9-10H,4-8H2,2H3/b10-9+
InChIKeyLZIAORKGKKMTSM-MDZDMXLPSA-N
MW136.24 g/mol
LogP3.15
Rot. Bonds5

About (E)-dec-5-en-1-yne

(E)-dec-5-en-1-yne (PubChem CID 6437054) has the molecular formula C10H16 and a molecular weight of 136.24 g/mol. Its IUPAC name is (E)-dec-5-en-1-yne.

Molecular Properties

Compound Name(E)-dec-5-en-1-yne
PubChem CID6437054
Molecular FormulaC10H16
Molecular Weight136.24 g/mol
Exact Mass136.13
IUPAC Name(E)-dec-5-en-1-yne
SMILESC#CCC/C=C/CCCC
InChIInChI=1S/C10H16/c1-3-5-7-9-10-8-6-4-2/h1,9-10H,4-8H2,2H3/b10-9+
InChIKeyLZIAORKGKKMTSM-MDZDMXLPSA-N
XLogP3.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.24
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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-1-yne?
The IUPAC name of (E)-dec-5-en-1-yne (CID 6437054) is (E)-dec-5-en-1-yne.
What is the SMILES notation for (E)-dec-5-en-1-yne?
The canonical SMILES for (E)-dec-5-en-1-yne is C#CCC/C=C/CCCC.
What is the InChIKey of (E)-dec-5-en-1-yne?
The InChIKey is LZIAORKGKKMTSM-MDZDMXLPSA-N. The full InChI is InChI=1S/C10H16/c1-3-5-7-9-10-8-6-4-2/h1,9-10H,4-8H2,2H3/b10-9+.
What are the key properties of (E)-dec-5-en-1-yne?
(E)-dec-5-en-1-yne has a molecular weight of 136.24 g/mol, XLogP of 3.15, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-dec-5-en-1-yne is sourced from PubChem (CID 6437054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).