1-fluoroethoxymethyl 2-methylprop-2-enoate

C7H11FO3 — CID 59816439

IUPAC1-fluoroethoxymethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCOC(C)F
InChIInChI=1S/C7H11FO3/c1-5(2)7(9)11-4-10-6(3)8/h6H,1,4H2,2-3H3
InChIKeyXGOLDRZMYONTTP-UHFFFAOYSA-N
MW162.16 g/mol
LogP1.40
Rot. Bonds4

About 1-fluoroethoxymethyl 2-methylprop-2-enoate

1-fluoroethoxymethyl 2-methylprop-2-enoate (PubChem CID 59816439) has the molecular formula C7H11FO3 and a molecular weight of 162.16 g/mol. Its IUPAC name is 1-fluoroethoxymethyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name1-fluoroethoxymethyl 2-methylprop-2-enoate
PubChem CID59816439
Molecular FormulaC7H11FO3
Molecular Weight162.16 g/mol
Exact Mass162.07
IUPAC Name1-fluoroethoxymethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCOC(C)F
InChIInChI=1S/C7H11FO3/c1-5(2)7(9)11-4-10-6(3)8/h6H,1,4H2,2-3H3
InChIKeyXGOLDRZMYONTTP-UHFFFAOYSA-N
XLogP1.40
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.16
LogP ≤ 51.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-methylpentan-2-yloxymethyl 2-methylprop-2-enoate
CID 59189148
4-(2-methylprop-2-enoyloxymethoxy)butoxymethyl 2-methylprop-2-enoate
CID 58944381
2,3-dimethylbutyl 2-methylprop-2-enoate
CID 18361655
3-propan-2-yloxypropyl 2-methylprop-2-enoate
CID 23399612
2,3,4,4-tetrafluorobutyl 2-methylprop-2-enoate
CID 87071251
ethyl 2-methylprop-2-enoate
CID 130475774
ethene;2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate
CID 173009937
hydroxymethyl 2-methylprop-2-enoate
CID 159274421
[(2S,4S)-4-(2-methylprop-2-enoyloxy)pentan-2-yl] 2-methylprop-2-enoate
CID 101184166
2-[2-[2-[2-[2-[2-[2-[2-(2-methylprop-2-enoyloxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propyl 2-methylprop-2-enoate
CID 18762108
9-propan-2-yloxynonyl 2-methylprop-2-enoate
CID 58451766
2,3,4,5,6,7-hexafluoroheptyl 2-methylprop-2-enoate
CID 174639375

Frequently Asked Questions

What is the IUPAC name of 1-fluoroethoxymethyl 2-methylprop-2-enoate?
The IUPAC name of 1-fluoroethoxymethyl 2-methylprop-2-enoate (CID 59816439) is 1-fluoroethoxymethyl 2-methylprop-2-enoate.
What is the SMILES notation for 1-fluoroethoxymethyl 2-methylprop-2-enoate?
The canonical SMILES for 1-fluoroethoxymethyl 2-methylprop-2-enoate is C=C(C)C(=O)OCOC(C)F.
What is the InChIKey of 1-fluoroethoxymethyl 2-methylprop-2-enoate?
The InChIKey is XGOLDRZMYONTTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11FO3/c1-5(2)7(9)11-4-10-6(3)8/h6H,1,4H2,2-3H3.
What are the key properties of 1-fluoroethoxymethyl 2-methylprop-2-enoate?
1-fluoroethoxymethyl 2-methylprop-2-enoate has a molecular weight of 162.16 g/mol, XLogP of 1.40, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoroethoxymethyl 2-methylprop-2-enoate is sourced from PubChem (CID 59816439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).