2-fluoroethyl cyclopropanecarboxylate

C6H9FO2 — CID 130693210

IUPAC2-fluoroethyl cyclopropanecarboxylate
SMILESO=C(OCCF)C1CC1
InChIInChI=1S/C6H9FO2/c7-3-4-9-6(8)5-1-2-5/h5H,1-4H2
InChIKeyUZQUBDLLJUCPQC-UHFFFAOYSA-N
MW132.13 g/mol
LogP0.91
Rot. Bonds3

About 2-fluoroethyl cyclopropanecarboxylate

2-fluoroethyl cyclopropanecarboxylate (PubChem CID 130693210) has the molecular formula C6H9FO2 and a molecular weight of 132.13 g/mol. Its IUPAC name is 2-fluoroethyl cyclopropanecarboxylate.

Molecular Properties

Compound Name2-fluoroethyl cyclopropanecarboxylate
PubChem CID130693210
Molecular FormulaC6H9FO2
Molecular Weight132.13 g/mol
Exact Mass132.06
IUPAC Name2-fluoroethyl cyclopropanecarboxylate
SMILESO=C(OCCF)C1CC1
InChIInChI=1S/C6H9FO2/c7-3-4-9-6(8)5-1-2-5/h5H,1-4H2
InChIKeyUZQUBDLLJUCPQC-UHFFFAOYSA-N
XLogP0.91
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.13
LogP ≤ 50.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-fluoroethyl cyclopropanecarboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-fluoroethyl cyclobutanecarboxylate
CID 45090053
butyl 4-(2-fluoroethyl)cyclohexane-1-carboxylate
CID 70829178
propyl 4-(aminomethyl)cyclohexane-1-carboxylate
CID 79524646
2-aminoethyl cyclohexanecarboxylate;hydrochloride
CID 67519694
4-[2-(2-hydroxyethoxy)ethoxycarbonyl]cyclohexane-1-carboxylic acid
CID 66983093
butyl 4-carbonofluoridoylcyclohexane-1-carboxylate
CID 155468002
4-O-decyl 1-O-octyl cyclohexane-1,4-dicarboxylate
CID 66984073
propyl 4-hydroxycyclohexane-1-carboxylate
CID 71338866
pentadecyl cyclopropanecarboxylate
CID 560133
cyclopropanecarbonyl chloride;2-[2-[2-(cyclopropanecarbonyloxy)ethoxy]ethoxy]ethyl cyclopropanecarboxylate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol
CID 159662744
4-methylpentyl cyclopropanecarboxylate
CID 550148
hexadecyl cyclopropanecarboxylate;silver
CID 87290012

Frequently Asked Questions

What is the IUPAC name of 2-fluoroethyl cyclopropanecarboxylate?
The IUPAC name of 2-fluoroethyl cyclopropanecarboxylate (CID 130693210) is 2-fluoroethyl cyclopropanecarboxylate.
What is the SMILES notation for 2-fluoroethyl cyclopropanecarboxylate?
The canonical SMILES for 2-fluoroethyl cyclopropanecarboxylate is O=C(OCCF)C1CC1.
What is the InChIKey of 2-fluoroethyl cyclopropanecarboxylate?
The InChIKey is UZQUBDLLJUCPQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9FO2/c7-3-4-9-6(8)5-1-2-5/h5H,1-4H2.
What are the key properties of 2-fluoroethyl cyclopropanecarboxylate?
2-fluoroethyl cyclopropanecarboxylate has a molecular weight of 132.13 g/mol, XLogP of 0.91, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoroethyl cyclopropanecarboxylate is sourced from PubChem (CID 130693210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).