methyl 3-(2-methoxyethoxy)-2-methylprop-2-enoate

C8H14O4 — CID 175087641

IUPACmethyl 3-(2-methoxyethoxy)-2-methylprop-2-enoate
SMILESCOCCOC=C(C)C(=O)OC
InChIInChI=1S/C8H14O4/c1-7(8(9)11-3)6-12-5-4-10-2/h6H,4-5H2,1-3H3
InChIKeyHBGKWMFZFCLSGB-UHFFFAOYSA-N
MW174.20 g/mol
LogP0.73
Rot. Bonds5

About methyl 3-(2-methoxyethoxy)-2-methylprop-2-enoate

methyl 3-(2-methoxyethoxy)-2-methylprop-2-enoate (PubChem CID 175087641) has the molecular formula C8H14O4 and a molecular weight of 174.20 g/mol. Its IUPAC name is methyl 3-(2-methoxyethoxy)-2-methylprop-2-enoate.

Molecular Properties

Compound Namemethyl 3-(2-methoxyethoxy)-2-methylprop-2-enoate
PubChem CID175087641
Molecular FormulaC8H14O4
Molecular Weight174.20 g/mol
Exact Mass174.09
IUPAC Namemethyl 3-(2-methoxyethoxy)-2-methylprop-2-enoate
SMILESCOCCOC=C(C)C(=O)OC
InChIInChI=1S/C8H14O4/c1-7(8(9)11-3)6-12-5-4-10-2/h6H,4-5H2,1-3H3
InChIKeyHBGKWMFZFCLSGB-UHFFFAOYSA-N
XLogP0.73
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 50.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

methyl 2-methyl-3-(2-phosphonooxyethoxy)prop-2-enoate
CID 175087282
3-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-2-methylprop-2-enoic acid
CID 173082103
3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylprop-2-enoic acid
CID 56998613
carbonic acid;bis(methyl 3-(2,3-dihydroxypropoxy)-2-methylprop-2-enoate)
CID 175100517
1,2-dimethoxyethane;methyl 2-methylprop-2-enoate
CID 175106203
ethyl 3-(2-aminoethoxy)-2-methylprop-2-enoate
CID 173442797
methyl 3-[(3-ethyloxetan-3-yl)methoxy]-2-methylprop-2-enoate
CID 174767758
methyl (E)-2-methyl-3-(trifluoromethoxy)prop-2-enoate
CID 89069178
ethyl 3-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]-2-methylprop-2-enoate
CID 174610941
methyl 3-chloro-2-methylprop-2-enoate
CID 54075272
methyl (Z)-3-fluoro-2-methylprop-2-enoate
CID 12587009
methyl (E)-3-chloro-2-methylprop-2-enoate
CID 12586999

Frequently Asked Questions

What is the IUPAC name of methyl 3-(2-methoxyethoxy)-2-methylprop-2-enoate?
The IUPAC name of methyl 3-(2-methoxyethoxy)-2-methylprop-2-enoate (CID 175087641) is methyl 3-(2-methoxyethoxy)-2-methylprop-2-enoate.
What is the SMILES notation for methyl 3-(2-methoxyethoxy)-2-methylprop-2-enoate?
The canonical SMILES for methyl 3-(2-methoxyethoxy)-2-methylprop-2-enoate is COCCOC=C(C)C(=O)OC.
What is the InChIKey of methyl 3-(2-methoxyethoxy)-2-methylprop-2-enoate?
The InChIKey is HBGKWMFZFCLSGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O4/c1-7(8(9)11-3)6-12-5-4-10-2/h6H,4-5H2,1-3H3.
What are the key properties of methyl 3-(2-methoxyethoxy)-2-methylprop-2-enoate?
methyl 3-(2-methoxyethoxy)-2-methylprop-2-enoate has a molecular weight of 174.20 g/mol, XLogP of 0.73, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 3-(2-methoxyethoxy)-2-methylprop-2-enoate is sourced from PubChem (CID 175087641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).