1,1,1,2,2,3-hexafluoro-3-(1,2,2,3,3-pentafluoropropoxy)propane

C6H3F11O — CID 175373279

IUPAC1,1,1,2,2,3-hexafluoro-3-(1,2,2,3,3-pentafluoropropoxy)propane
SMILESFC(F)C(F)(F)C(F)OC(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C6H3F11O/c7-1(8)4(11,12)2(9)18-3(10)5(13,14)6(15,16)17/h1-3H
InChIKeyBFNCONKRHDMACP-UHFFFAOYSA-N
MW300.07 g/mol
LogP3.69
Rot. Bonds5

About 1,1,1,2,2,3-hexafluoro-3-(1,2,2,3,3-pentafluoropropoxy)propane

1,1,1,2,2,3-hexafluoro-3-(1,2,2,3,3-pentafluoropropoxy)propane (PubChem CID 175373279) has the molecular formula C6H3F11O and a molecular weight of 300.07 g/mol. Its IUPAC name is 1,1,1,2,2,3-hexafluoro-3-(1,2,2,3,3-pentafluoropropoxy)propane.

Molecular Properties

Compound Name1,1,1,2,2,3-hexafluoro-3-(1,2,2,3,3-pentafluoropropoxy)propane
PubChem CID175373279
Molecular FormulaC6H3F11O
Molecular Weight300.07 g/mol
Exact Mass300.00
IUPAC Name1,1,1,2,2,3-hexafluoro-3-(1,2,2,3,3-pentafluoropropoxy)propane
SMILESFC(F)C(F)(F)C(F)OC(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C6H3F11O/c7-1(8)4(11,12)2(9)18-3(10)5(13,14)6(15,16)17/h1-3H
InChIKeyBFNCONKRHDMACP-UHFFFAOYSA-N
XLogP3.69
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.07
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 1,1,1,2,2,3-hexafluoro-3-(1,2,2,3,3-pentafluoropropoxy)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

1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11-henicosafluoro-11-(1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11-henicosafluoroundecoxy)undecane
CID 88791163
1,1,1,2,2,3,3-heptafluoropropane;methane
CID 158693034
1,1,1,2,2,3,3-heptafluoropropane;hydrobromide
CID 175862099
CID 172837284
CID 172837284
1,1,1,2,2,3,3-heptafluoropropane;hydrochloride
CID 158268992
1-(1,2,2,3,3,4,4,5,5,6,6,6-dodecafluorohexoxy)-2,2,3,3,4,4,4-heptafluorobutan-1-ol
CID 57277387
1,1,1,2,3,3,4-heptafluoro-4-(1,2,2,3,4,4,4-heptafluorobutoxy)butane;methoxymethane;1,1,1,2-tetrafluoroethane
CID 175408970
4-(1,2,2,3,3,3-hexafluoropropoxy)aniline
CID 174979795
1,1,2,2,3,3,4,4-octafluoro-5-[1,1,2-trifluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)ethoxy]pentane
CID 134451384
2-[[2-(difluoromethyl)-2,3,3,3-tetrafluoropropoxy]methyl]-1,1,1,2,3,3-hexafluoropropane
CID 87137039
2,2,3,3,4,4,5,5-octafluoropentyl hypoiodite
CID 148632122
1-[1,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]-1,1,2,2,2-pentafluoroethane
CID 175740142

Frequently Asked Questions

What is the IUPAC name of 1,1,1,2,2,3-hexafluoro-3-(1,2,2,3,3-pentafluoropropoxy)propane?
The IUPAC name of 1,1,1,2,2,3-hexafluoro-3-(1,2,2,3,3-pentafluoropropoxy)propane (CID 175373279) is 1,1,1,2,2,3-hexafluoro-3-(1,2,2,3,3-pentafluoropropoxy)propane.
What is the SMILES notation for 1,1,1,2,2,3-hexafluoro-3-(1,2,2,3,3-pentafluoropropoxy)propane?
The canonical SMILES for 1,1,1,2,2,3-hexafluoro-3-(1,2,2,3,3-pentafluoropropoxy)propane is FC(F)C(F)(F)C(F)OC(F)C(F)(F)C(F)(F)F.
What is the InChIKey of 1,1,1,2,2,3-hexafluoro-3-(1,2,2,3,3-pentafluoropropoxy)propane?
The InChIKey is BFNCONKRHDMACP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3F11O/c7-1(8)4(11,12)2(9)18-3(10)5(13,14)6(15,16)17/h1-3H.
What are the key properties of 1,1,1,2,2,3-hexafluoro-3-(1,2,2,3,3-pentafluoropropoxy)propane?
1,1,1,2,2,3-hexafluoro-3-(1,2,2,3,3-pentafluoropropoxy)propane has a molecular weight of 300.07 g/mol, XLogP of 3.69, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1,2,2,3-hexafluoro-3-(1,2,2,3,3-pentafluoropropoxy)propane is sourced from PubChem (CID 175373279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).