(E)-dec-2-en-4,6,8-triyn-1-ol

C10H8O — CID 6365178

IUPAC(E)-dec-2-en-4,6,8-triyn-1-ol
SMILESCC#CC#CC#C/C=C/CO
InChIInChI=1S/C10H8O/c1-2-3-4-5-6-7-8-9-10-11/h8-9,11H,10H2,1H3/b9-8+
InChIKeyJTVVPVMSFPTJLN-CMDGGOBGSA-N
MW144.17 g/mol
LogP0.56
Rot. Bonds1

About (E)-dec-2-en-4,6,8-triyn-1-ol

(E)-dec-2-en-4,6,8-triyn-1-ol (PubChem CID 6365178) has the molecular formula C10H8O and a molecular weight of 144.17 g/mol. Its IUPAC name is (E)-dec-2-en-4,6,8-triyn-1-ol.

Molecular Properties

Compound Name(E)-dec-2-en-4,6,8-triyn-1-ol
PubChem CID6365178
Molecular FormulaC10H8O
Molecular Weight144.17 g/mol
Exact Mass144.06
IUPAC Name(E)-dec-2-en-4,6,8-triyn-1-ol
SMILESCC#CC#CC#C/C=C/CO
InChIInChI=1S/C10H8O/c1-2-3-4-5-6-7-8-9-10-11/h8-9,11H,10H2,1H3/b9-8+
InChIKeyJTVVPVMSFPTJLN-CMDGGOBGSA-N
XLogP0.56
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.17
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (E)-dec-2-en-4,6,8-triyn-1-ol?
The IUPAC name of (E)-dec-2-en-4,6,8-triyn-1-ol (CID 6365178) is (E)-dec-2-en-4,6,8-triyn-1-ol.
What is the SMILES notation for (E)-dec-2-en-4,6,8-triyn-1-ol?
The canonical SMILES for (E)-dec-2-en-4,6,8-triyn-1-ol is CC#CC#CC#C/C=C/CO.
What is the InChIKey of (E)-dec-2-en-4,6,8-triyn-1-ol?
The InChIKey is JTVVPVMSFPTJLN-CMDGGOBGSA-N. The full InChI is InChI=1S/C10H8O/c1-2-3-4-5-6-7-8-9-10-11/h8-9,11H,10H2,1H3/b9-8+.
What are the key properties of (E)-dec-2-en-4,6,8-triyn-1-ol?
(E)-dec-2-en-4,6,8-triyn-1-ol has a molecular weight of 144.17 g/mol, XLogP of 0.56, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-dec-2-en-4,6,8-triyn-1-ol is sourced from PubChem (CID 6365178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).