1-(2,2,3,3-tetrafluoropropoxy)pentane

C8H14F4O — CID 11229430

IUPAC1-(2,2,3,3-tetrafluoropropoxy)pentane
SMILESCCCCCOCC(F)(F)C(F)F
InChIInChI=1S/C8H14F4O/c1-2-3-4-5-13-6-8(11,12)7(9)10/h7H,2-6H2,1H3
InChIKeyIGBFKIZHLXGOPU-UHFFFAOYSA-N
MW202.19 g/mol
LogP3.09
Rot. Bonds7

About 1-(2,2,3,3-tetrafluoropropoxy)pentane

1-(2,2,3,3-tetrafluoropropoxy)pentane (PubChem CID 11229430) has the molecular formula C8H14F4O and a molecular weight of 202.19 g/mol. Its IUPAC name is 1-(2,2,3,3-tetrafluoropropoxy)pentane.

Molecular Properties

Compound Name1-(2,2,3,3-tetrafluoropropoxy)pentane
PubChem CID11229430
Molecular FormulaC8H14F4O
Molecular Weight202.19 g/mol
Exact Mass202.10
IUPAC Name1-(2,2,3,3-tetrafluoropropoxy)pentane
SMILESCCCCCOCC(F)(F)C(F)F
InChIInChI=1S/C8H14F4O/c1-2-3-4-5-13-6-8(11,12)7(9)10/h7H,2-6H2,1H3
InChIKeyIGBFKIZHLXGOPU-UHFFFAOYSA-N
XLogP3.09
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.19
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1,1,2,2,3,3,4,4-Octafluoro-5-(1,1,2,2-tetrafluoroethoxy)pentane
CID 2782579
1,1,1,2,3,3-Hexafluoro-4-(1,1,2,3,3,3-hexafluoropropoxy)pentane
CID 71405907
n-Butyl 1,1,2,2-tetrafluoroethyl ether
CID 9659
1-Ethoxy-1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane
CID 23432499
1,1,1,2,2,3,3,4,4-Nonafluoro-6-propoxyhexane
CID 44480565
1,1,1,2,2,3,3,4,4-Nonafluoro-6-(pentyloxy)hexane
CID 44480566
6-(1,1-Difluoroethoxy)-1,1,1,2,2,3,3,4,4,5,5-undecafluorohexane
CID 85753373
1-Ethoxy-1,1,2,3,3,3-hexafluoro-2-(trifluoromethyl)propane--1-ethoxy-1,1,2,2,3,3,4,4,4-nonafluorobutane (1/1)
CID 118797041
(Perfluorohexyl)ethyl ether
CID 87277022
Decafluoro-di-n-pentylether
CID 11688646
Pentane, 1,1'-oxybis[2,2,3,3,4,4,5,5-octafluoro-
CID 12100158
Bis(1-(perfluorobutyl)ethyl) ether
CID 21954135

Frequently Asked Questions

What is the IUPAC name of 1-(2,2,3,3-tetrafluoropropoxy)pentane?
The IUPAC name of 1-(2,2,3,3-tetrafluoropropoxy)pentane (CID 11229430) is 1-(2,2,3,3-tetrafluoropropoxy)pentane.
What is the SMILES notation for 1-(2,2,3,3-tetrafluoropropoxy)pentane?
The canonical SMILES for 1-(2,2,3,3-tetrafluoropropoxy)pentane is CCCCCOCC(F)(F)C(F)F.
What is the InChIKey of 1-(2,2,3,3-tetrafluoropropoxy)pentane?
The InChIKey is IGBFKIZHLXGOPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F4O/c1-2-3-4-5-13-6-8(11,12)7(9)10/h7H,2-6H2,1H3.
What are the key properties of 1-(2,2,3,3-tetrafluoropropoxy)pentane?
1-(2,2,3,3-tetrafluoropropoxy)pentane has a molecular weight of 202.19 g/mol, XLogP of 3.09, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2,3,3-tetrafluoropropoxy)pentane is sourced from PubChem (CID 11229430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).