2,2,3,3-tetrafluoro-1-methoxypentane

C6H10F4O — CID 168826300

IUPAC2,2,3,3-tetrafluoro-1-methoxypentane
SMILESCCC(F)(F)C(F)(F)COC
InChIInChI=1S/C6H10F4O/c1-3-5(7,8)6(9,10)4-11-2/h3-4H2,1-2H3
InChIKeyHVQHRBCZMCIZQZ-UHFFFAOYSA-N
MW174.14 g/mol
LogP2.31
Rot. Bonds4

About 2,2,3,3-tetrafluoro-1-methoxypentane

2,2,3,3-tetrafluoro-1-methoxypentane (PubChem CID 168826300) has the molecular formula C6H10F4O and a molecular weight of 174.14 g/mol. Its IUPAC name is 2,2,3,3-tetrafluoro-1-methoxypentane.

Molecular Properties

Compound Name2,2,3,3-tetrafluoro-1-methoxypentane
PubChem CID168826300
Molecular FormulaC6H10F4O
Molecular Weight174.14 g/mol
Exact Mass174.07
IUPAC Name2,2,3,3-tetrafluoro-1-methoxypentane
SMILESCCC(F)(F)C(F)(F)COC
InChIInChI=1S/C6H10F4O/c1-3-5(7,8)6(9,10)4-11-2/h3-4H2,1-2H3
InChIKeyHVQHRBCZMCIZQZ-UHFFFAOYSA-N
XLogP2.31
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.14
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2,2,3,3-tetrafluoro-1-methoxypentane 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

1,1,1,2,2-pentafluoro-3-methoxypropane
CID 2776015
2,2,3,3-tetrafluoro-1-methoxybutane
CID 59343885
1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluoro-8-methoxyoctane
CID 21057502
1,1,1,2,2,3,3,4,4,5,5-undecafluoro-6-methoxyhexane
CID 71669115
2,2,3,3,4,4,5,5,6,6-decafluoro-1-methoxyheptane
CID 158825980
3,4-diethyl-3,4-bis(methoxymethyl)hexane
CID 22153406
1,1,1,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12-tetracosafluoro-13-methoxy-2-(trifluoromethyl)tridecane
CID 170095555
ethane;2-fluoro-1-methoxy-2-methylpropane
CID 176980153
3,5-bis(methoxymethyl)-3,5-dimethylheptane
CID 21036025
1,1,1,3,3,3-hexafluoro-2-(methoxymethyl)-2-methylpropane
CID 21062401
2,2,3,3-tetrafluoropentane
CID 12951106
1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluorobutoxy)ethanethiol
CID 118098168

Frequently Asked Questions

What is the IUPAC name of 2,2,3,3-tetrafluoro-1-methoxypentane?
The IUPAC name of 2,2,3,3-tetrafluoro-1-methoxypentane (CID 168826300) is 2,2,3,3-tetrafluoro-1-methoxypentane.
What is the SMILES notation for 2,2,3,3-tetrafluoro-1-methoxypentane?
The canonical SMILES for 2,2,3,3-tetrafluoro-1-methoxypentane is CCC(F)(F)C(F)(F)COC.
What is the InChIKey of 2,2,3,3-tetrafluoro-1-methoxypentane?
The InChIKey is HVQHRBCZMCIZQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F4O/c1-3-5(7,8)6(9,10)4-11-2/h3-4H2,1-2H3.
What are the key properties of 2,2,3,3-tetrafluoro-1-methoxypentane?
2,2,3,3-tetrafluoro-1-methoxypentane has a molecular weight of 174.14 g/mol, XLogP of 2.31, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3-tetrafluoro-1-methoxypentane is sourced from PubChem (CID 168826300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).