2-[2-(oxiran-2-ylmethoxy)ethoxymethyl]oxirane

C8H14O4 — CID 16683

IUPAC2-[2-(oxiran-2-ylmethoxy)ethoxymethyl]oxirane
SMILESC(COCC1CO1)OCC1CO1
InChIInChI=1S/C8H14O4/c1(9-3-7-5-11-7)2-10-4-8-6-12-8/h7-8H,1-6H2
InChIKeyAOBIOSPNXBMOAT-UHFFFAOYSA-N
MW174.20 g/mol
LogP-0.18
Rot. Bonds7

About 2-[2-(oxiran-2-ylmethoxy)ethoxymethyl]oxirane

2-[2-(oxiran-2-ylmethoxy)ethoxymethyl]oxirane (PubChem CID 16683) has the molecular formula C8H14O4 and a molecular weight of 174.20 g/mol. Its IUPAC name is 2-[2-(oxiran-2-ylmethoxy)ethoxymethyl]oxirane.

Molecular Properties

Compound Name2-[2-(oxiran-2-ylmethoxy)ethoxymethyl]oxirane
PubChem CID16683
Molecular FormulaC8H14O4
Molecular Weight174.20 g/mol
Exact Mass174.09
IUPAC Name2-[2-(oxiran-2-ylmethoxy)ethoxymethyl]oxirane
SMILESC(COCC1CO1)OCC1CO1
InChIInChI=1S/C8H14O4/c1(9-3-7-5-11-7)2-10-4-8-6-12-8/h7-8H,1-6H2
InChIKeyAOBIOSPNXBMOAT-UHFFFAOYSA-N
XLogP-0.18
TPSA43.52 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 5-0.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

1,4-Butanediol diglycidyl ether
CID 17046
Triethylene Glycol Diglycidyl Ether
CID 16058
Neopentyl glycol diglycidyl ether
CID 28594
Diglycidyl ether
CID 16704
Triglycidylglycerol
CID 25795
Diethylene glycol diglycidyl ether
CID 351024
2,2'-(Oxybis((methyl-2,1-ethanediyl)oxymethylene))bis(oxirane)
CID 3034475
Glycerol propoxylate triglycidyl ether
CID 114953
Propylene glycol diglycidyl ether homopolymer
CID 85959
1,3-Bis(2,3-epoxypropoxy)butane
CID 97961
Oxirane, 2,2'-(2,5,8,11,14-pentaoxapentadecane-1,15-diyl)bis-
CID 86596
Oxirane, 2,2'-[1,3-propanediylbis(oxymethylene)]bis-
CID 3081505

Frequently Asked Questions

What is the IUPAC name of 2-[2-(oxiran-2-ylmethoxy)ethoxymethyl]oxirane?
The IUPAC name of 2-[2-(oxiran-2-ylmethoxy)ethoxymethyl]oxirane (CID 16683) is 2-[2-(oxiran-2-ylmethoxy)ethoxymethyl]oxirane.
What is the SMILES notation for 2-[2-(oxiran-2-ylmethoxy)ethoxymethyl]oxirane?
The canonical SMILES for 2-[2-(oxiran-2-ylmethoxy)ethoxymethyl]oxirane is C(COCC1CO1)OCC1CO1.
What is the InChIKey of 2-[2-(oxiran-2-ylmethoxy)ethoxymethyl]oxirane?
The InChIKey is AOBIOSPNXBMOAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O4/c1(9-3-7-5-11-7)2-10-4-8-6-12-8/h7-8H,1-6H2.
What are the key properties of 2-[2-(oxiran-2-ylmethoxy)ethoxymethyl]oxirane?
2-[2-(oxiran-2-ylmethoxy)ethoxymethyl]oxirane has a molecular weight of 174.20 g/mol, XLogP of -0.18, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(oxiran-2-ylmethoxy)ethoxymethyl]oxirane is sourced from PubChem (CID 16683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).