2-[2-(2-chloroethoxy)ethoxymethyl]furan

C9H13ClO3 — CID 63664804

IUPAC2-[2-(2-chloroethoxy)ethoxymethyl]furan
SMILESClCCOCCOCc1ccco1
InChIInChI=1S/C9H13ClO3/c10-3-5-11-6-7-12-8-9-2-1-4-13-9/h1-2,4H,3,5-8H2
InChIKeyXPMYZUMXPUWEHF-UHFFFAOYSA-N
MW204.65 g/mol
LogP2.05
Rot. Bonds7

About 2-[2-(2-chloroethoxy)ethoxymethyl]furan

2-[2-(2-chloroethoxy)ethoxymethyl]furan (PubChem CID 63664804) has the molecular formula C9H13ClO3 and a molecular weight of 204.65 g/mol. Its IUPAC name is 2-[2-(2-chloroethoxy)ethoxymethyl]furan.

Molecular Properties

Compound Name2-[2-(2-chloroethoxy)ethoxymethyl]furan
PubChem CID63664804
Molecular FormulaC9H13ClO3
Molecular Weight204.65 g/mol
Exact Mass204.06
IUPAC Name2-[2-(2-chloroethoxy)ethoxymethyl]furan
SMILESClCCOCCOCc1ccco1
InChIInChI=1S/C9H13ClO3/c10-3-5-11-6-7-12-8-9-2-1-4-13-9/h1-2,4H,3,5-8H2
InChIKeyXPMYZUMXPUWEHF-UHFFFAOYSA-N
XLogP2.05
TPSA31.60 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.65
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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

2-[2-[2-[2-[2-(furan-2-ylmethoxy)ethoxy]ethoxy]ethoxy]ethoxymethyl]furan
CID 102488556
1-[2-(furan-2-ylmethoxy)ethoxy]ethanol
CID 20517706
2-(fluoromethoxymethyl)furan
CID 143116843
2-(6-bromohexoxymethyl)furan
CID 86031197
3-(furan-2-ylmethoxy)propanoic acid
CID 24710839
3-chloro-N-[3-(furan-2-ylmethoxy)propyl]propanamide
CID 61251673
2-(ethylperoxymethyl)furan
CID 175094388
4-bromo-N-[2-(furan-2-ylmethoxy)ethyl]aniline
CID 55088628
furan-2-ylmethoxy-[[[furan-2-ylmethoxy(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilane
CID 70907109
2-[3-(furan-2-ylmethoxy)propoxy]aniline
CID 43174360
N-[2-(furan-2-ylmethoxy)ethyl]-2-methoxyethanamine
CID 62565000
furan-2-ylmethoxysilane
CID 130768813

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-chloroethoxy)ethoxymethyl]furan?
The IUPAC name of 2-[2-(2-chloroethoxy)ethoxymethyl]furan (CID 63664804) is 2-[2-(2-chloroethoxy)ethoxymethyl]furan.
What is the SMILES notation for 2-[2-(2-chloroethoxy)ethoxymethyl]furan?
The canonical SMILES for 2-[2-(2-chloroethoxy)ethoxymethyl]furan is ClCCOCCOCc1ccco1.
What is the InChIKey of 2-[2-(2-chloroethoxy)ethoxymethyl]furan?
The InChIKey is XPMYZUMXPUWEHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13ClO3/c10-3-5-11-6-7-12-8-9-2-1-4-13-9/h1-2,4H,3,5-8H2.
What are the key properties of 2-[2-(2-chloroethoxy)ethoxymethyl]furan?
2-[2-(2-chloroethoxy)ethoxymethyl]furan has a molecular weight of 204.65 g/mol, XLogP of 2.05, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-chloroethoxy)ethoxymethyl]furan is sourced from PubChem (CID 63664804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).