1-chloro-2-methoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutane

C10H19ClO4 — CID 104674207

IUPAC1-chloro-2-methoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutane
SMILESCOCCOCCOC1CC(Cl)C1OC
InChIInChI=1S/C10H19ClO4/c1-12-3-4-14-5-6-15-9-7-8(11)10(9)13-2/h8-10H,3-7H2,1-2H3
InChIKeyKLKZIMIZVUKSDA-UHFFFAOYSA-N
MW238.71 g/mol
LogP1.06
Rot. Bonds8

About 1-chloro-2-methoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutane

1-chloro-2-methoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutane (PubChem CID 104674207) has the molecular formula C10H19ClO4 and a molecular weight of 238.71 g/mol. Its IUPAC name is 1-chloro-2-methoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutane.

Molecular Properties

Compound Name1-chloro-2-methoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutane
PubChem CID104674207
Molecular FormulaC10H19ClO4
Molecular Weight238.71 g/mol
Exact Mass238.10
IUPAC Name1-chloro-2-methoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutane
SMILESCOCCOCCOC1CC(Cl)C1OC
InChIInChI=1S/C10H19ClO4/c1-12-3-4-14-5-6-15-9-7-8(11)10(9)13-2/h8-10H,3-7H2,1-2H3
InChIKeyKLKZIMIZVUKSDA-UHFFFAOYSA-N
XLogP1.06
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.71
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-chloro-2-ethoxy-3-(2-methoxyethoxy)cyclobutane
CID 104675611
1-chloro-2-ethoxy-3-(2-ethoxyethoxy)cyclobutane
CID 104675598
2-methoxy-3-[2-(3-methoxypropoxy)ethoxy]cyclobutan-1-ol
CID 103176139
2-ethoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutan-1-amine
CID 104676703
1-bromo-2-methoxy-3-(2-propoxyethoxy)cyclobutane
CID 104674096
1-chloro-3-[3-(2-methoxyethoxy)propoxy]cyclobutane
CID 103408042
1-methoxy-2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethane
CID 140812368
1,2-dimethoxyethane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 159847962
1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane
CID 8189
1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 87439194
1-iodo-2-[2-(2-methoxyethoxy)ethoxy]cyclopentane
CID 114775120
2-(2-methoxyethoxy)-3-[2-(2-methylpropoxy)ethoxy]cyclobutan-1-amine
CID 114032306

Frequently Asked Questions

What is the IUPAC name of 1-chloro-2-methoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutane?
The IUPAC name of 1-chloro-2-methoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutane (CID 104674207) is 1-chloro-2-methoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutane.
What is the SMILES notation for 1-chloro-2-methoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutane?
The canonical SMILES for 1-chloro-2-methoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutane is COCCOCCOC1CC(Cl)C1OC.
What is the InChIKey of 1-chloro-2-methoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutane?
The InChIKey is KLKZIMIZVUKSDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19ClO4/c1-12-3-4-14-5-6-15-9-7-8(11)10(9)13-2/h8-10H,3-7H2,1-2H3.
What are the key properties of 1-chloro-2-methoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutane?
1-chloro-2-methoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutane has a molecular weight of 238.71 g/mol, XLogP of 1.06, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-2-methoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutane is sourced from PubChem (CID 104674207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).