2-(2-ethenoxyethyl)-2-methyloxane

C10H18O2 — CID 176603794

IUPAC2-(2-ethenoxyethyl)-2-methyloxane
SMILESC=COCCC1(C)CCCCO1
InChIInChI=1S/C10H18O2/c1-3-11-9-7-10(2)6-4-5-8-12-10/h3H,1,4-9H2,2H3
InChIKeyICXBYJHAXWJCQX-UHFFFAOYSA-N
MW170.25 g/mol
LogP2.50
Rot. Bonds4

About 2-(2-ethenoxyethyl)-2-methyloxane

2-(2-ethenoxyethyl)-2-methyloxane (PubChem CID 176603794) has the molecular formula C10H18O2 and a molecular weight of 170.25 g/mol. Its IUPAC name is 2-(2-ethenoxyethyl)-2-methyloxane.

Molecular Properties

Compound Name2-(2-ethenoxyethyl)-2-methyloxane
PubChem CID176603794
Molecular FormulaC10H18O2
Molecular Weight170.25 g/mol
Exact Mass170.13
IUPAC Name2-(2-ethenoxyethyl)-2-methyloxane
SMILESC=COCCC1(C)CCCCO1
InChIInChI=1S/C10H18O2/c1-3-11-9-7-10(2)6-4-5-8-12-10/h3H,1,4-9H2,2H3
InChIKeyICXBYJHAXWJCQX-UHFFFAOYSA-N
XLogP2.50
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.25
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2,2-Diethyloxane
CID 15620795
1,2,2-Triethyloxan-1-ium
CID 20512699
2-Ethyl-2-methyltetrahydropyran
CID 20540603
4-Ethoxy-2-ethyl-4-methyloxane
CID 22162646
2-Hexyl-4-methoxy-2,4-dimethyloxane
CID 22162651
(2R)-2-ethyl-2-methyloxane
CID 25420259
3,5-Bis(ethenoxy)-3,5-dimethylheptane
CID 126733535
4-Ethenoxy-3-pentyloxane
CID 149900729
2,2-Dimethyloxane;ethene
CID 168913071
2-(Ethenoxymethyl)-2-methyloxane
CID 176603187
2-Methyl-2-[2-(2-methylprop-1-enoxy)ethyl]oxane
CID 176604335
2-methyl-2-[2-[(E)-prop-1-enoxy]ethyl]oxane
CID 176604612

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethenoxyethyl)-2-methyloxane?
The IUPAC name of 2-(2-ethenoxyethyl)-2-methyloxane (CID 176603794) is 2-(2-ethenoxyethyl)-2-methyloxane.
What is the SMILES notation for 2-(2-ethenoxyethyl)-2-methyloxane?
The canonical SMILES for 2-(2-ethenoxyethyl)-2-methyloxane is C=COCCC1(C)CCCCO1.
What is the InChIKey of 2-(2-ethenoxyethyl)-2-methyloxane?
The InChIKey is ICXBYJHAXWJCQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O2/c1-3-11-9-7-10(2)6-4-5-8-12-10/h3H,1,4-9H2,2H3.
What are the key properties of 2-(2-ethenoxyethyl)-2-methyloxane?
2-(2-ethenoxyethyl)-2-methyloxane has a molecular weight of 170.25 g/mol, XLogP of 2.50, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethenoxyethyl)-2-methyloxane is sourced from PubChem (CID 176603794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).