(2E,8E)-deca-2,8-dien-4,6-diyne-1,10-diol

C10H10O2 — CID 10057822

IUPAC(2E,8E)-deca-2,8-dien-4,6-diyne-1,10-diol
SMILESOC/C=C/C#CC#C/C=C/CO
InChIInChI=1S/C10H10O2/c11-9-7-5-3-1-2-4-6-8-10-12/h5-8,11-12H,9-10H2/b7-5+,8-6+
InChIKeyVUBHWNWEHZFTFD-KQQUZDAGSA-N
MW162.19 g/mol
LogP0.09
Rot. Bonds2

About (2E,8E)-deca-2,8-dien-4,6-diyne-1,10-diol

(2E,8E)-deca-2,8-dien-4,6-diyne-1,10-diol (PubChem CID 10057822) has the molecular formula C10H10O2 and a molecular weight of 162.19 g/mol. Its IUPAC name is (2E,8E)-deca-2,8-dien-4,6-diyne-1,10-diol.

Molecular Properties

Compound Name(2E,8E)-deca-2,8-dien-4,6-diyne-1,10-diol
PubChem CID10057822
Molecular FormulaC10H10O2
Molecular Weight162.19 g/mol
Exact Mass162.07
IUPAC Name(2E,8E)-deca-2,8-dien-4,6-diyne-1,10-diol
SMILESOC/C=C/C#CC#C/C=C/CO
InChIInChI=1S/C10H10O2/c11-9-7-5-3-1-2-4-6-8-10-12/h5-8,11-12H,9-10H2/b7-5+,8-6+
InChIKeyVUBHWNWEHZFTFD-KQQUZDAGSA-N
XLogP0.09
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 50.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 (2E,8E)-deca-2,8-dien-4,6-diyne-1,10-diol?
The IUPAC name of (2E,8E)-deca-2,8-dien-4,6-diyne-1,10-diol (CID 10057822) is (2E,8E)-deca-2,8-dien-4,6-diyne-1,10-diol.
What is the SMILES notation for (2E,8E)-deca-2,8-dien-4,6-diyne-1,10-diol?
The canonical SMILES for (2E,8E)-deca-2,8-dien-4,6-diyne-1,10-diol is OC/C=C/C#CC#C/C=C/CO.
What is the InChIKey of (2E,8E)-deca-2,8-dien-4,6-diyne-1,10-diol?
The InChIKey is VUBHWNWEHZFTFD-KQQUZDAGSA-N. The full InChI is InChI=1S/C10H10O2/c11-9-7-5-3-1-2-4-6-8-10-12/h5-8,11-12H,9-10H2/b7-5+,8-6+.
What are the key properties of (2E,8E)-deca-2,8-dien-4,6-diyne-1,10-diol?
(2E,8E)-deca-2,8-dien-4,6-diyne-1,10-diol has a molecular weight of 162.19 g/mol, XLogP of 0.09, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,8E)-deca-2,8-dien-4,6-diyne-1,10-diol is sourced from PubChem (CID 10057822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).