1,1,2,2-tetrafluoro-3-(2,2,3,3-tetrafluoropropoxymethoxy)propane

C7H8F8O2 — CID 12839497

IUPAC1,1,2,2-tetrafluoro-3-(2,2,3,3-tetrafluoropropoxymethoxy)propane
SMILESFC(F)C(F)(F)COCOCC(F)(F)C(F)F
InChIInChI=1S/C7H8F8O2/c8-4(9)6(12,13)1-16-3-17-2-7(14,15)5(10)11/h4-5H,1-3H2
InChIKeyGOJDQBUTQNNFII-UHFFFAOYSA-N
MW276.12 g/mol
LogP2.78
Rot. Bonds8

About 1,1,2,2-tetrafluoro-3-(2,2,3,3-tetrafluoropropoxymethoxy)propane

1,1,2,2-tetrafluoro-3-(2,2,3,3-tetrafluoropropoxymethoxy)propane (PubChem CID 12839497) has the molecular formula C7H8F8O2 and a molecular weight of 276.12 g/mol. Its IUPAC name is 1,1,2,2-tetrafluoro-3-(2,2,3,3-tetrafluoropropoxymethoxy)propane.

Molecular Properties

Compound Name1,1,2,2-tetrafluoro-3-(2,2,3,3-tetrafluoropropoxymethoxy)propane
PubChem CID12839497
Molecular FormulaC7H8F8O2
Molecular Weight276.12 g/mol
Exact Mass276.04
IUPAC Name1,1,2,2-tetrafluoro-3-(2,2,3,3-tetrafluoropropoxymethoxy)propane
SMILESFC(F)C(F)(F)COCOCC(F)(F)C(F)F
InChIInChI=1S/C7H8F8O2/c8-4(9)6(12,13)1-16-3-17-2-7(14,15)5(10)11/h4-5H,1-3H2
InChIKeyGOJDQBUTQNNFII-UHFFFAOYSA-N
XLogP2.78
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.12
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

Analyze 1,1,2,2-tetrafluoro-3-(2,2,3,3-tetrafluoropropoxymethoxy)propane 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

Bis(2,2,3,3-tetrafluoropropyl) Carbonate
CID 11659296
Tris(2,2,2-trifluoroethyl)orthoformate
CID 3685970
Ethyl 2,2,3,3-tetrafluoropropyl carbonate
CID 42634538
Bis(2,2,2-trifluoroethoxy)methane
CID 11367834
1,1,2,2,3,3,4,4-Octafluoro-5-{[(2,2,3,3,4,4,5,5-octafluoropentyl)oxy]methoxy}pentane
CID 618624
Bis(2-fluoroethoxy)methane
CID 88850796
Perfluoroacetone ethyl methyl ketal
CID 19707458
Bis-(tetrafluoropropyl)-carbonate
CID 87308878
1,1,1-Trifluoro-2-[1-(2,2,2-trifluoroethoxy)ethoxy]ethane
CID 87694334
1-Fluoro-2-(2-fluoroethoxymethoxymethoxy)ethane
CID 91374954
2-[Difluoro(2,2,2-trifluoroethoxy)methoxy]-1,1,1-trifluoroethane
CID 14203789
1-(2,2,3,3-Tetrafluoropropoxy)ethyl 2,2,3,3-tetrafluoropropyl ether
CID 12929800

Frequently Asked Questions

What is the IUPAC name of 1,1,2,2-tetrafluoro-3-(2,2,3,3-tetrafluoropropoxymethoxy)propane?
The IUPAC name of 1,1,2,2-tetrafluoro-3-(2,2,3,3-tetrafluoropropoxymethoxy)propane (CID 12839497) is 1,1,2,2-tetrafluoro-3-(2,2,3,3-tetrafluoropropoxymethoxy)propane.
What is the SMILES notation for 1,1,2,2-tetrafluoro-3-(2,2,3,3-tetrafluoropropoxymethoxy)propane?
The canonical SMILES for 1,1,2,2-tetrafluoro-3-(2,2,3,3-tetrafluoropropoxymethoxy)propane is FC(F)C(F)(F)COCOCC(F)(F)C(F)F.
What is the InChIKey of 1,1,2,2-tetrafluoro-3-(2,2,3,3-tetrafluoropropoxymethoxy)propane?
The InChIKey is GOJDQBUTQNNFII-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F8O2/c8-4(9)6(12,13)1-16-3-17-2-7(14,15)5(10)11/h4-5H,1-3H2.
What are the key properties of 1,1,2,2-tetrafluoro-3-(2,2,3,3-tetrafluoropropoxymethoxy)propane?
1,1,2,2-tetrafluoro-3-(2,2,3,3-tetrafluoropropoxymethoxy)propane has a molecular weight of 276.12 g/mol, XLogP of 2.78, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,2-tetrafluoro-3-(2,2,3,3-tetrafluoropropoxymethoxy)propane is sourced from PubChem (CID 12839497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).