ethene;2-(oxiran-2-ylmethoxymethyl)oxirane;prop-1-ene

C11H20O3 — CID 23018396

IUPACethene;2-(oxiran-2-ylmethoxymethyl)oxirane;prop-1-ene
SMILESC(OCC1CO1)C1CO1.C=C.C=CC
InChIInChI=1S/C6H10O3.C3H6.C2H4/c1(5-3-8-5)7-2-6-4-9-6;1-3-2;1-2/h5-6H,1-4H2;3H,1H2,2H3;1-2H2
InChIKeyPRWHXRATTBKYDG-UHFFFAOYSA-N
MW200.28 g/mol
LogP1.80
Rot. Bonds4

About ethene;2-(oxiran-2-ylmethoxymethyl)oxirane;prop-1-ene

ethene;2-(oxiran-2-ylmethoxymethyl)oxirane;prop-1-ene (PubChem CID 23018396) has the molecular formula C11H20O3 and a molecular weight of 200.28 g/mol. Its IUPAC name is ethene;2-(oxiran-2-ylmethoxymethyl)oxirane;prop-1-ene.

Molecular Properties

Compound Nameethene;2-(oxiran-2-ylmethoxymethyl)oxirane;prop-1-ene
PubChem CID23018396
Molecular FormulaC11H20O3
Molecular Weight200.28 g/mol
Exact Mass200.14
IUPAC Nameethene;2-(oxiran-2-ylmethoxymethyl)oxirane;prop-1-ene
SMILESC(OCC1CO1)C1CO1.C=C.C=CC
InChIInChI=1S/C6H10O3.C3H6.C2H4/c1(5-3-8-5)7-2-6-4-9-6;1-3-2;1-2/h5-6H,1-4H2;3H,1H2,2H3;1-2H2
InChIKeyPRWHXRATTBKYDG-UHFFFAOYSA-N
XLogP1.80
TPSA34.29 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

ethane-1,2-diol;2-(oxiran-2-ylmethoxymethyl)oxirane;tetrakis(prop-1-ene)
CID 173030236
2-methylbut-2-ene;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 87813388
methane;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 167637417
ethene;2-methyloxirane;2-(prop-2-enoxymethyl)oxirane
CID 174606995
2-methylprop-1-ene;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 87296159
ethane-1,2-diol;ethene;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 173313374
bis(2-(prop-2-enoxymethyl)oxirane);hydrate
CID 87216937
ethanol;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 87071861
1-ethenoxy-2-methylpropane;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 174399004
methoxysilane;2-(prop-2-enoxymethyl)oxirane
CID 173273777
methoxyethene;2-(prop-2-enoxymethyl)oxirane
CID 174894893
2-(oxiran-2-ylmethoxymethyl)oxirane;oxophosphane
CID 22290133

Frequently Asked Questions

What is the IUPAC name of ethene;2-(oxiran-2-ylmethoxymethyl)oxirane;prop-1-ene?
The IUPAC name of ethene;2-(oxiran-2-ylmethoxymethyl)oxirane;prop-1-ene (CID 23018396) is ethene;2-(oxiran-2-ylmethoxymethyl)oxirane;prop-1-ene.
What is the SMILES notation for ethene;2-(oxiran-2-ylmethoxymethyl)oxirane;prop-1-ene?
The canonical SMILES for ethene;2-(oxiran-2-ylmethoxymethyl)oxirane;prop-1-ene is C(OCC1CO1)C1CO1.C=C.C=CC.
What is the InChIKey of ethene;2-(oxiran-2-ylmethoxymethyl)oxirane;prop-1-ene?
The InChIKey is PRWHXRATTBKYDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O3.C3H6.C2H4/c1(5-3-8-5)7-2-6-4-9-6;1-3-2;1-2/h5-6H,1-4H2;3H,1H2,2H3;1-2H2.
What are the key properties of ethene;2-(oxiran-2-ylmethoxymethyl)oxirane;prop-1-ene?
ethene;2-(oxiran-2-ylmethoxymethyl)oxirane;prop-1-ene has a molecular weight of 200.28 g/mol, XLogP of 1.80, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;2-(oxiran-2-ylmethoxymethyl)oxirane;prop-1-ene is sourced from PubChem (CID 23018396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).