2-(methoxymethoxymethyl)-3-methylidenehept-1-ene

C11H20O2 — CID 134835043

IUPAC2-(methoxymethoxymethyl)-3-methylidenehept-1-ene
SMILESC=C(CCCC)C(=C)COCOC
InChIInChI=1S/C11H20O2/c1-5-6-7-10(2)11(3)8-13-9-12-4/h2-3,5-9H2,1,4H3
InChIKeyMOKDZIPTNMMRMZ-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.91
Rot. Bonds8

About 2-(methoxymethoxymethyl)-3-methylidenehept-1-ene

2-(methoxymethoxymethyl)-3-methylidenehept-1-ene (PubChem CID 134835043) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 2-(methoxymethoxymethyl)-3-methylidenehept-1-ene.

Molecular Properties

Compound Name2-(methoxymethoxymethyl)-3-methylidenehept-1-ene
PubChem CID134835043
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name2-(methoxymethoxymethyl)-3-methylidenehept-1-ene
SMILESC=C(CCCC)C(=C)COCOC
InChIInChI=1S/C11H20O2/c1-5-6-7-10(2)11(3)8-13-9-12-4/h2-3,5-9H2,1,4H3
InChIKeyMOKDZIPTNMMRMZ-UHFFFAOYSA-N
XLogP2.91
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethoxymethyl)-3-methylidenehept-1-ene?
The IUPAC name of 2-(methoxymethoxymethyl)-3-methylidenehept-1-ene (CID 134835043) is 2-(methoxymethoxymethyl)-3-methylidenehept-1-ene.
What is the SMILES notation for 2-(methoxymethoxymethyl)-3-methylidenehept-1-ene?
The canonical SMILES for 2-(methoxymethoxymethyl)-3-methylidenehept-1-ene is C=C(CCCC)C(=C)COCOC.
What is the InChIKey of 2-(methoxymethoxymethyl)-3-methylidenehept-1-ene?
The InChIKey is MOKDZIPTNMMRMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-5-6-7-10(2)11(3)8-13-9-12-4/h2-3,5-9H2,1,4H3.
What are the key properties of 2-(methoxymethoxymethyl)-3-methylidenehept-1-ene?
2-(methoxymethoxymethyl)-3-methylidenehept-1-ene has a molecular weight of 184.28 g/mol, XLogP of 2.91, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethoxymethyl)-3-methylidenehept-1-ene is sourced from PubChem (CID 134835043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).