1-[2-(2-methoxyethoxy)ethoxy]-2-methylidenecyclopropane

C9H16O3 — CID 101369678

IUPAC1-[2-(2-methoxyethoxy)ethoxy]-2-methylidenecyclopropane
SMILESC=C1CC1OCCOCCOC
InChIInChI=1S/C9H16O3/c1-8-7-9(8)12-6-5-11-4-3-10-2/h9H,1,3-7H2,2H3
InChIKeyRQDMTEAQCALFRY-UHFFFAOYSA-N
MW172.22 g/mol
LogP0.99
Rot. Bonds7

About 1-[2-(2-methoxyethoxy)ethoxy]-2-methylidenecyclopropane

1-[2-(2-methoxyethoxy)ethoxy]-2-methylidenecyclopropane (PubChem CID 101369678) has the molecular formula C9H16O3 and a molecular weight of 172.22 g/mol. Its IUPAC name is 1-[2-(2-methoxyethoxy)ethoxy]-2-methylidenecyclopropane.

Molecular Properties

Compound Name1-[2-(2-methoxyethoxy)ethoxy]-2-methylidenecyclopropane
PubChem CID101369678
Molecular FormulaC9H16O3
Molecular Weight172.22 g/mol
Exact Mass172.11
IUPAC Name1-[2-(2-methoxyethoxy)ethoxy]-2-methylidenecyclopropane
SMILESC=C1CC1OCCOCCOC
InChIInChI=1S/C9H16O3/c1-8-7-9(8)12-6-5-11-4-3-10-2/h9H,1,3-7H2,2H3
InChIKeyRQDMTEAQCALFRY-UHFFFAOYSA-N
XLogP0.99
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.22
LogP ≤ 50.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-t-Butoxy-2-methylidenecyclopropane
CID 12738386
3-(1-Methoxypropan-2-yloxy)-2-methylprop-1-ene
CID 14746504
2-Methyl-3-[2-[2-(2-methylprop-2-enoxy)propoxy]propoxy]prop-1-ene
CID 20269759
3-[2-(2-Methylprop-2-enoxy)propoxy]but-1-ene
CID 57890813
2-(2,3-Dimethoxypropoxy)-3-methylbuta-1,3-diene
CID 59816976
2-Methyl-3-[2-[2-(2-methylprop-2-enoxy)propoxy]ethoxy]prop-1-ene
CID 60100983
1,2-Dimethoxy-3-methylidenepentane
CID 87932706
2-(3-Methylbut-3-en-2-yloxymethyl)oxirane
CID 88958408
2-(1-Methoxypropan-2-yloxy)-3-methylbuta-1,3-diene
CID 89083367
2-(3-Methoxybut-3-en-2-yloxy)-3-methylbut-2-ene
CID 91595527
2-(3-Methoxy-2-propan-2-yloxypropoxy)-3-methylbuta-1,3-diene
CID 117767781
2-Methyl-3-[2-(2-methylprop-2-enoxy)propoxy]prop-1-ene
CID 129069600

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-methoxyethoxy)ethoxy]-2-methylidenecyclopropane?
The IUPAC name of 1-[2-(2-methoxyethoxy)ethoxy]-2-methylidenecyclopropane (CID 101369678) is 1-[2-(2-methoxyethoxy)ethoxy]-2-methylidenecyclopropane.
What is the SMILES notation for 1-[2-(2-methoxyethoxy)ethoxy]-2-methylidenecyclopropane?
The canonical SMILES for 1-[2-(2-methoxyethoxy)ethoxy]-2-methylidenecyclopropane is C=C1CC1OCCOCCOC.
What is the InChIKey of 1-[2-(2-methoxyethoxy)ethoxy]-2-methylidenecyclopropane?
The InChIKey is RQDMTEAQCALFRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O3/c1-8-7-9(8)12-6-5-11-4-3-10-2/h9H,1,3-7H2,2H3.
What are the key properties of 1-[2-(2-methoxyethoxy)ethoxy]-2-methylidenecyclopropane?
1-[2-(2-methoxyethoxy)ethoxy]-2-methylidenecyclopropane has a molecular weight of 172.22 g/mol, XLogP of 0.99, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methoxyethoxy)ethoxy]-2-methylidenecyclopropane is sourced from PubChem (CID 101369678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).