4,7-bis(prop-2-enoxy)deca-1,9-diene

C16H26O2 — CID 10586810

IUPAC4,7-bis(prop-2-enoxy)deca-1,9-diene
SMILESC=CCOC(CC=C)CCC(CC=C)OCC=C
InChIInChI=1S/C16H26O2/c1-5-9-15(17-13-7-3)11-12-16(10-6-2)18-14-8-4/h5-8,15-16H,1-4,9-14H2
InChIKeyNJGCBIBINTYZGD-UHFFFAOYSA-N
MW250.38 g/mol
LogP4.06
Rot. Bonds13

About 4,7-bis(prop-2-enoxy)deca-1,9-diene

4,7-bis(prop-2-enoxy)deca-1,9-diene (PubChem CID 10586810) has the molecular formula C16H26O2 and a molecular weight of 250.38 g/mol. Its IUPAC name is 4,7-bis(prop-2-enoxy)deca-1,9-diene.

Molecular Properties

Compound Name4,7-bis(prop-2-enoxy)deca-1,9-diene
PubChem CID10586810
Molecular FormulaC16H26O2
Molecular Weight250.38 g/mol
Exact Mass250.19
IUPAC Name4,7-bis(prop-2-enoxy)deca-1,9-diene
SMILESC=CCOC(CC=C)CCC(CC=C)OCC=C
InChIInChI=1S/C16H26O2/c1-5-9-15(17-13-7-3)11-12-16(10-6-2)18-14-8-4/h5-8,15-16H,1-4,9-14H2
InChIKeyNJGCBIBINTYZGD-UHFFFAOYSA-N
XLogP4.06
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.38
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4,7-bis(prop-2-enoxy)deca-1,9-diene?
The IUPAC name of 4,7-bis(prop-2-enoxy)deca-1,9-diene (CID 10586810) is 4,7-bis(prop-2-enoxy)deca-1,9-diene.
What is the SMILES notation for 4,7-bis(prop-2-enoxy)deca-1,9-diene?
The canonical SMILES for 4,7-bis(prop-2-enoxy)deca-1,9-diene is C=CCOC(CC=C)CCC(CC=C)OCC=C.
What is the InChIKey of 4,7-bis(prop-2-enoxy)deca-1,9-diene?
The InChIKey is NJGCBIBINTYZGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26O2/c1-5-9-15(17-13-7-3)11-12-16(10-6-2)18-14-8-4/h5-8,15-16H,1-4,9-14H2.
What are the key properties of 4,7-bis(prop-2-enoxy)deca-1,9-diene?
4,7-bis(prop-2-enoxy)deca-1,9-diene has a molecular weight of 250.38 g/mol, XLogP of 4.06, 13 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,7-bis(prop-2-enoxy)deca-1,9-diene is sourced from PubChem (CID 10586810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).