6-(2-methoxyethoxy)-3-methylidenehex-1-ene;2-methoxyprop-1-ene

C14H26O3 — CID 144564677

IUPAC6-(2-methoxyethoxy)-3-methylidenehex-1-ene;2-methoxyprop-1-ene
SMILESC=C(C)OC.C=CC(=C)CCCOCCOC
InChIInChI=1S/C10H18O2.C4H8O/c1-4-10(2)6-5-7-12-9-8-11-3;1-4(2)5-3/h4H,1-2,5-9H2,3H3;1H2,2-3H3
InChIKeyCCWWIUWVQDMYFK-UHFFFAOYSA-N
MW242.36 g/mol
LogP3.34
Rot. Bonds9

About 6-(2-methoxyethoxy)-3-methylidenehex-1-ene;2-methoxyprop-1-ene

6-(2-methoxyethoxy)-3-methylidenehex-1-ene;2-methoxyprop-1-ene (PubChem CID 144564677) has the molecular formula C14H26O3 and a molecular weight of 242.36 g/mol. Its IUPAC name is 6-(2-methoxyethoxy)-3-methylidenehex-1-ene;2-methoxyprop-1-ene.

Molecular Properties

Compound Name6-(2-methoxyethoxy)-3-methylidenehex-1-ene;2-methoxyprop-1-ene
PubChem CID144564677
Molecular FormulaC14H26O3
Molecular Weight242.36 g/mol
Exact Mass242.19
IUPAC Name6-(2-methoxyethoxy)-3-methylidenehex-1-ene;2-methoxyprop-1-ene
SMILESC=C(C)OC.C=CC(=C)CCCOCCOC
InChIInChI=1S/C10H18O2.C4H8O/c1-4-10(2)6-5-7-12-9-8-11-3;1-4(2)5-3/h4H,1-2,5-9H2,3H3;1H2,2-3H3
InChIKeyCCWWIUWVQDMYFK-UHFFFAOYSA-N
XLogP3.34
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-(2-methoxyethoxy)-3-methylidenehex-1-ene;2-methoxyprop-1-ene?
The IUPAC name of 6-(2-methoxyethoxy)-3-methylidenehex-1-ene;2-methoxyprop-1-ene (CID 144564677) is 6-(2-methoxyethoxy)-3-methylidenehex-1-ene;2-methoxyprop-1-ene.
What is the SMILES notation for 6-(2-methoxyethoxy)-3-methylidenehex-1-ene;2-methoxyprop-1-ene?
The canonical SMILES for 6-(2-methoxyethoxy)-3-methylidenehex-1-ene;2-methoxyprop-1-ene is C=C(C)OC.C=CC(=C)CCCOCCOC.
What is the InChIKey of 6-(2-methoxyethoxy)-3-methylidenehex-1-ene;2-methoxyprop-1-ene?
The InChIKey is CCWWIUWVQDMYFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O2.C4H8O/c1-4-10(2)6-5-7-12-9-8-11-3;1-4(2)5-3/h4H,1-2,5-9H2,3H3;1H2,2-3H3.
What are the key properties of 6-(2-methoxyethoxy)-3-methylidenehex-1-ene;2-methoxyprop-1-ene?
6-(2-methoxyethoxy)-3-methylidenehex-1-ene;2-methoxyprop-1-ene has a molecular weight of 242.36 g/mol, XLogP of 3.34, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methoxyethoxy)-3-methylidenehex-1-ene;2-methoxyprop-1-ene is sourced from PubChem (CID 144564677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).