(Z)-1,1-diethoxydec-7-en-4-ol

C14H28O3 — CID 14078616

IUPAC(Z)-1,1-diethoxydec-7-en-4-ol
SMILESCC/C=C\CCC(O)CCC(OCC)OCC
InChIInChI=1S/C14H28O3/c1-4-7-8-9-10-13(15)11-12-14(16-5-2)17-6-3/h7-8,13-15H,4-6,9-12H2,1-3H3/b8-7-
InChIKeyCGDYZKZMGKZSMG-FPLPWBNLSA-N
MW244.37 g/mol
LogP3.27
Rot. Bonds11

About (Z)-1,1-diethoxydec-7-en-4-ol

(Z)-1,1-diethoxydec-7-en-4-ol (PubChem CID 14078616) has the molecular formula C14H28O3 and a molecular weight of 244.37 g/mol. Its IUPAC name is (Z)-1,1-diethoxydec-7-en-4-ol.

Molecular Properties

Compound Name(Z)-1,1-diethoxydec-7-en-4-ol
PubChem CID14078616
Molecular FormulaC14H28O3
Molecular Weight244.37 g/mol
Exact Mass244.20
IUPAC Name(Z)-1,1-diethoxydec-7-en-4-ol
SMILESCC/C=C\CCC(O)CCC(OCC)OCC
InChIInChI=1S/C14H28O3/c1-4-7-8-9-10-13(15)11-12-14(16-5-2)17-6-3/h7-8,13-15H,4-6,9-12H2,1-3H3/b8-7-
InChIKeyCGDYZKZMGKZSMG-FPLPWBNLSA-N
XLogP3.27
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.37
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-1,1-diethoxydec-7-en-4-ol?
The IUPAC name of (Z)-1,1-diethoxydec-7-en-4-ol (CID 14078616) is (Z)-1,1-diethoxydec-7-en-4-ol.
What is the SMILES notation for (Z)-1,1-diethoxydec-7-en-4-ol?
The canonical SMILES for (Z)-1,1-diethoxydec-7-en-4-ol is CC/C=C\CCC(O)CCC(OCC)OCC.
What is the InChIKey of (Z)-1,1-diethoxydec-7-en-4-ol?
The InChIKey is CGDYZKZMGKZSMG-FPLPWBNLSA-N. The full InChI is InChI=1S/C14H28O3/c1-4-7-8-9-10-13(15)11-12-14(16-5-2)17-6-3/h7-8,13-15H,4-6,9-12H2,1-3H3/b8-7-.
What are the key properties of (Z)-1,1-diethoxydec-7-en-4-ol?
(Z)-1,1-diethoxydec-7-en-4-ol has a molecular weight of 244.37 g/mol, XLogP of 3.27, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1,1-diethoxydec-7-en-4-ol is sourced from PubChem (CID 14078616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).