2-[1-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate

C14H22O6 — CID 12062939

IUPAC2-[1-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCOC(C)OCCOC(=O)C(=C)C
InChIInChI=1S/C14H22O6/c1-10(2)13(15)19-8-6-17-12(5)18-7-9-20-14(16)11(3)4/h12H,1,3,6-9H2,2,4-5H3
InChIKeyJFTXKTLPMWYATG-UHFFFAOYSA-N
MW286.32 g/mol
LogP1.60
Rot. Bonds10

About 2-[1-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate

2-[1-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate (PubChem CID 12062939) has the molecular formula C14H22O6 and a molecular weight of 286.32 g/mol. Its IUPAC name is 2-[1-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name2-[1-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate
PubChem CID12062939
Molecular FormulaC14H22O6
Molecular Weight286.32 g/mol
Exact Mass286.14
IUPAC Name2-[1-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCOC(C)OCCOC(=O)C(=C)C
InChIInChI=1S/C14H22O6/c1-10(2)13(15)19-8-6-17-12(5)18-7-9-20-14(16)11(3)4/h12H,1,3,6-9H2,2,4-5H3
InChIKeyJFTXKTLPMWYATG-UHFFFAOYSA-N
XLogP1.60
TPSA71.06 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.32
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate?
The IUPAC name of 2-[1-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate (CID 12062939) is 2-[1-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate.
What is the SMILES notation for 2-[1-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate?
The canonical SMILES for 2-[1-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate is C=C(C)C(=O)OCCOC(C)OCCOC(=O)C(=C)C.
What is the InChIKey of 2-[1-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate?
The InChIKey is JFTXKTLPMWYATG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O6/c1-10(2)13(15)19-8-6-17-12(5)18-7-9-20-14(16)11(3)4/h12H,1,3,6-9H2,2,4-5H3.
What are the key properties of 2-[1-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate?
2-[1-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate has a molecular weight of 286.32 g/mol, XLogP of 1.60, 10 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate is sourced from PubChem (CID 12062939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).