ethyl (Z)-2-fluoropent-2-enoate

C7H11FO2 — CID 14691806

IUPACethyl (Z)-2-fluoropent-2-enoate
SMILESCC/C=C(\F)C(=O)OCC
InChIInChI=1S/C7H11FO2/c1-3-5-6(8)7(9)10-4-2/h5H,3-4H2,1-2H3/b6-5-
InChIKeyGZLWORFDFXKXKN-WAYWQWQTSA-N
MW146.16 g/mol
LogP1.81
Rot. Bonds3

About ethyl (Z)-2-fluoropent-2-enoate

ethyl (Z)-2-fluoropent-2-enoate (PubChem CID 14691806) has the molecular formula C7H11FO2 and a molecular weight of 146.16 g/mol. Its IUPAC name is ethyl (Z)-2-fluoropent-2-enoate.

Molecular Properties

Compound Nameethyl (Z)-2-fluoropent-2-enoate
PubChem CID14691806
Molecular FormulaC7H11FO2
Molecular Weight146.16 g/mol
Exact Mass146.07
IUPAC Nameethyl (Z)-2-fluoropent-2-enoate
SMILESCC/C=C(\F)C(=O)OCC
InChIInChI=1S/C7H11FO2/c1-3-5-6(8)7(9)10-4-2/h5H,3-4H2,1-2H3/b6-5-
InChIKeyGZLWORFDFXKXKN-WAYWQWQTSA-N
XLogP1.81
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.16
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of ethyl (Z)-2-fluoropent-2-enoate?
The IUPAC name of ethyl (Z)-2-fluoropent-2-enoate (CID 14691806) is ethyl (Z)-2-fluoropent-2-enoate.
What is the SMILES notation for ethyl (Z)-2-fluoropent-2-enoate?
The canonical SMILES for ethyl (Z)-2-fluoropent-2-enoate is CC/C=C(\F)C(=O)OCC.
What is the InChIKey of ethyl (Z)-2-fluoropent-2-enoate?
The InChIKey is GZLWORFDFXKXKN-WAYWQWQTSA-N. The full InChI is InChI=1S/C7H11FO2/c1-3-5-6(8)7(9)10-4-2/h5H,3-4H2,1-2H3/b6-5-.
What are the key properties of ethyl (Z)-2-fluoropent-2-enoate?
ethyl (Z)-2-fluoropent-2-enoate has a molecular weight of 146.16 g/mol, XLogP of 1.81, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl (Z)-2-fluoropent-2-enoate is sourced from PubChem (CID 14691806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).