fluoro 2-fluorohexanoate;hydrochloride

C6H11ClF2O2 — CID 174751179

IUPACfluoro 2-fluorohexanoate;hydrochloride
SMILESCCCCC(F)C(=O)OF.Cl
InChIInChI=1S/C6H10F2O2.ClH/c1-2-3-4-5(7)6(9)10-8;/h5H,2-4H2,1H3;1H
InChIKeyGINNXSUXNHZLMA-UHFFFAOYSA-N
MW188.60 g/mol
LogP2.36
Rot. Bonds4

About fluoro 2-fluorohexanoate;hydrochloride

fluoro 2-fluorohexanoate;hydrochloride (PubChem CID 174751179) has the molecular formula C6H11ClF2O2 and a molecular weight of 188.60 g/mol. Its IUPAC name is fluoro 2-fluorohexanoate;hydrochloride.

Molecular Properties

Compound Namefluoro 2-fluorohexanoate;hydrochloride
PubChem CID174751179
Molecular FormulaC6H11ClF2O2
Molecular Weight188.60 g/mol
Exact Mass188.04
IUPAC Namefluoro 2-fluorohexanoate;hydrochloride
SMILESCCCCC(F)C(=O)OF.Cl
InChIInChI=1S/C6H10F2O2.ClH/c1-2-3-4-5(7)6(9)10-8;/h5H,2-4H2,1H3;1H
InChIKeyGINNXSUXNHZLMA-UHFFFAOYSA-N
XLogP2.36
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.60
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze fluoro 2-fluorohexanoate;hydrochloride 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

ethyl (2R)-2-fluoroheptanoate
CID 102068873
2-fluorododecanoyl 2-fluorododecaneperoxoate
CID 175410514
methyl 2-fluorododecanoate
CID 86171800
methyl (2R)-2-fluorodecanoate
CID 11333185
hexyl 2-hydroxyhexanoate;hydrochloride
CID 174906603
butyl 2-butylhexanoate;stannane
CID 172996715
ethyl 2-aminohexanoate;hydrochloride
CID 18387178
2-fluoroundecanoic acid
CID 24976101
[4-[4-[(2R)-2-fluorooctanoyl]oxycyclohexyl]cyclohexyl] (2R)-2-fluorooctanoate
CID 56616838
2-hydroxyethyl 2-propylhexanoate
CID 58491956
[(3R)-3-fluoro-2-oxoheptyl]phosphonic acid
CID 88645077
2-hydroxyethyl 2-ethylhexanoate
CID 10397600

Frequently Asked Questions

What is the IUPAC name of fluoro 2-fluorohexanoate;hydrochloride?
The IUPAC name of fluoro 2-fluorohexanoate;hydrochloride (CID 174751179) is fluoro 2-fluorohexanoate;hydrochloride.
What is the SMILES notation for fluoro 2-fluorohexanoate;hydrochloride?
The canonical SMILES for fluoro 2-fluorohexanoate;hydrochloride is CCCCC(F)C(=O)OF.Cl.
What is the InChIKey of fluoro 2-fluorohexanoate;hydrochloride?
The InChIKey is GINNXSUXNHZLMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F2O2.ClH/c1-2-3-4-5(7)6(9)10-8;/h5H,2-4H2,1H3;1H.
What are the key properties of fluoro 2-fluorohexanoate;hydrochloride?
fluoro 2-fluorohexanoate;hydrochloride has a molecular weight of 188.60 g/mol, XLogP of 2.36, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for fluoro 2-fluorohexanoate;hydrochloride is sourced from PubChem (CID 174751179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).