1,3,3,4,4,5,5-heptafluoro-2-[2-[2-[2-[2-[3,3,4,4,5,5-hexafluoro-2-[2-[2-[2-[2-(2,3,3,4,4,5-hexafluorocyclopenten-1-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopenten-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopentene

C31H33F19O10 — CID 176591332

IUPAC1,3,3,4,4,5,5-heptafluoro-2-[2-[2-[2-[2-[3,3,4,4,5,5-hexafluoro-2-[2-[2-[2-[2-(2,3,3,4,4,5-hexafluorocyclopenten-1-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopenten-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopentene
SMILESFC1=C(OCCOCCOCCOCCOC2=C(OCCOCCOCCOCCOC3=C(F)C(F)(F)C(F)(F)C3(F)F)C(F)(F)C(F)(F)C2(F)F)C(F)C(F)(F)C1(F)F
InChIInChI=1S/C31H33F19O10/c32-18-17(19(33)25(37,38)24(18,35)36)57-13-9-53-5-1-51-3-7-55-11-15-59-22-23(29(45,46)31(49,50)28(22,43)44)60-16-12-56-8-4-52-2-6-54-10-14-58-21-20(34)26(39,40)30(47,48)27(21,41)42/h18H,1-16H2
InChIKeyTYGSKFFWFYHBMA-UHFFFAOYSA-N
MW926.56 g/mol
LogP7.19
Rot. Bonds28

About 1,3,3,4,4,5,5-heptafluoro-2-[2-[2-[2-[2-[3,3,4,4,5,5-hexafluoro-2-[2-[2-[2-[2-(2,3,3,4,4,5-hexafluorocyclopenten-1-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopenten-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopentene

1,3,3,4,4,5,5-heptafluoro-2-[2-[2-[2-[2-[3,3,4,4,5,5-hexafluoro-2-[2-[2-[2-[2-(2,3,3,4,4,5-hexafluorocyclopenten-1-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopenten-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopentene (PubChem CID 176591332) has the molecular formula C31H33F19O10 and a molecular weight of 926.56 g/mol. Its IUPAC name is 1,3,3,4,4,5,5-heptafluoro-2-[2-[2-[2-[2-[3,3,4,4,5,5-hexafluoro-2-[2-[2-[2-[2-(2,3,3,4,4,5-hexafluorocyclopenten-1-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopenten-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopentene.

Molecular Properties

Compound Name1,3,3,4,4,5,5-heptafluoro-2-[2-[2-[2-[2-[3,3,4,4,5,5-hexafluoro-2-[2-[2-[2-[2-(2,3,3,4,4,5-hexafluorocyclopenten-1-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopenten-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopentene
PubChem CID176591332
Molecular FormulaC31H33F19O10
Molecular Weight926.56 g/mol
Exact Mass926.18
IUPAC Name1,3,3,4,4,5,5-heptafluoro-2-[2-[2-[2-[2-[3,3,4,4,5,5-hexafluoro-2-[2-[2-[2-[2-(2,3,3,4,4,5-hexafluorocyclopenten-1-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopenten-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopentene
SMILESFC1=C(OCCOCCOCCOCCOC2=C(OCCOCCOCCOCCOC3=C(F)C(F)(F)C(F)(F)C3(F)F)C(F)(F)C(F)(F)C2(F)F)C(F)C(F)(F)C1(F)F
InChIInChI=1S/C31H33F19O10/c32-18-17(19(33)25(37,38)24(18,35)36)57-13-9-53-5-1-51-3-7-55-11-15-59-22-23(29(45,46)31(49,50)28(22,43)44)60-16-12-56-8-4-52-2-6-54-10-14-58-21-20(34)26(39,40)30(47,48)27(21,41)42/h18H,1-16H2
InChIKeyTYGSKFFWFYHBMA-UHFFFAOYSA-N
XLogP7.19
TPSA92.30 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds28
Heavy Atoms60
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500926.56
LogP ≤ 57.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

Analyze 1,3,3,4,4,5,5-heptafluoro-2-[2-[2-[2-[2-[3,3,4,4,5,5-hexafluoro-2-[2-[2-[2-[2-(2,3,3,4,4,5-hexafluorocyclopenten-1-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopenten-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopentene 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

10,10,11,11,12,12,22,22,23,23,24,24-Dodecafluoro-2,5,8,14,17,20-hexaoxatricyclo[19.3.0.09,13]tetracosa-1(21),9(13)-diene
CID 163615326
3,3,4,4,5,5-Hexafluoro-1-[2-(3,3,4,4,5,5-hexafluoro-2-methoxycyclopenten-1-yl)oxyethoxy]-2-methoxycyclopentene
CID 176591311
1,3,3,4,4,5,5-Heptafluoro-2-[2-[2-[2-[3,3,4,4,5,5-hexafluoro-2-[2-[2-[2-(2,3,3,4,4,5-hexafluorocyclopenten-1-yl)oxyethoxy]ethoxy]ethoxy]cyclopenten-1-yl]oxyethoxy]ethoxy]ethoxy]cyclopentene
CID 176591314
1,3,3,4,4,5,5-Heptafluoro-2-[3-[3,3,4,4,5,5-hexafluoro-2-[3-(2,3,3,4,4,5-hexafluorocyclopenten-1-yl)oxypropoxy]cyclopenten-1-yl]oxypropoxy]cyclopentene
CID 176591315
1,3,3,4,4,5,5-Heptafluoro-2-[6-[3,3,4,4,5,5-hexafluoro-2-[6-(2,3,3,4,4,5-hexafluorocyclopenten-1-yl)oxyhexoxy]cyclopenten-1-yl]oxyhexoxy]cyclopentene
CID 176591323
1,3,3,4,4,5,5-Heptafluoro-2-[4-[3,3,4,4,5,5-hexafluoro-2-[4-(2,3,3,4,4,5-hexafluorocyclopenten-1-yl)oxybutoxy]cyclopenten-1-yl]oxybutoxy]cyclopentene
CID 176591327
3-[2-[3,3,4,4,5,5-Hexafluoro-2-[2-[2-[2-[2-[3,3,4,4,5,5-hexafluoro-2-[2-(2-methoxyethoxy)ethoxy]cyclopenten-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopenten-1-yl]oxyethoxy]propan-1-ol
CID 176591334
2-[2-[2-[3,3,4,4,5,5-Hexafluoro-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]cyclopenten-1-yl]oxyethoxy]ethoxy]ethanol
CID 176591335
1-Butoxy-2-[2-[2-[2-(2-butoxy-3,3,4,4,5,5-hexafluorocyclopenten-1-yl)oxyethoxy]ethoxy]ethoxy]-3,3,4,4,5,5-hexafluorocyclopentene
CID 176591337
1,3,3,4,4,5,5-Heptafluoro-2-[2-[3,3,4,4,5,5-hexafluoro-2-[2-(2,3,3,4,4,5-hexafluorocyclopenten-1-yl)oxyethoxy]cyclopenten-1-yl]oxyethoxy]cyclopentene
CID 176591347
2-[2-[2-[2-[3,3,4,4,5,5-Hexafluoro-2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]cyclopenten-1-yl]oxyethoxy]ethoxy]ethoxy]ethanol
CID 176591351

Frequently Asked Questions

What is the IUPAC name of 1,3,3,4,4,5,5-heptafluoro-2-[2-[2-[2-[2-[3,3,4,4,5,5-hexafluoro-2-[2-[2-[2-[2-(2,3,3,4,4,5-hexafluorocyclopenten-1-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopenten-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopentene?
The IUPAC name of 1,3,3,4,4,5,5-heptafluoro-2-[2-[2-[2-[2-[3,3,4,4,5,5-hexafluoro-2-[2-[2-[2-[2-(2,3,3,4,4,5-hexafluorocyclopenten-1-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopenten-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopentene (CID 176591332) is 1,3,3,4,4,5,5-heptafluoro-2-[2-[2-[2-[2-[3,3,4,4,5,5-hexafluoro-2-[2-[2-[2-[2-(2,3,3,4,4,5-hexafluorocyclopenten-1-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopenten-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopentene.
What is the SMILES notation for 1,3,3,4,4,5,5-heptafluoro-2-[2-[2-[2-[2-[3,3,4,4,5,5-hexafluoro-2-[2-[2-[2-[2-(2,3,3,4,4,5-hexafluorocyclopenten-1-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopenten-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopentene?
The canonical SMILES for 1,3,3,4,4,5,5-heptafluoro-2-[2-[2-[2-[2-[3,3,4,4,5,5-hexafluoro-2-[2-[2-[2-[2-(2,3,3,4,4,5-hexafluorocyclopenten-1-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopenten-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopentene is FC1=C(OCCOCCOCCOCCOC2=C(OCCOCCOCCOCCOC3=C(F)C(F)(F)C(F)(F)C3(F)F)C(F)(F)C(F)(F)C2(F)F)C(F)C(F)(F)C1(F)F.
What is the InChIKey of 1,3,3,4,4,5,5-heptafluoro-2-[2-[2-[2-[2-[3,3,4,4,5,5-hexafluoro-2-[2-[2-[2-[2-(2,3,3,4,4,5-hexafluorocyclopenten-1-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopenten-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopentene?
The InChIKey is TYGSKFFWFYHBMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H33F19O10/c32-18-17(19(33)25(37,38)24(18,35)36)57-13-9-53-5-1-51-3-7-55-11-15-59-22-23(29(45,46)31(49,50)28(22,43)44)60-16-12-56-8-4-52-2-6-54-10-14-58-21-20(34)26(39,40)30(47,48)27(21,41)42/h18H,1-16H2.
What are the key properties of 1,3,3,4,4,5,5-heptafluoro-2-[2-[2-[2-[2-[3,3,4,4,5,5-hexafluoro-2-[2-[2-[2-[2-(2,3,3,4,4,5-hexafluorocyclopenten-1-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopenten-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopentene?
1,3,3,4,4,5,5-heptafluoro-2-[2-[2-[2-[2-[3,3,4,4,5,5-hexafluoro-2-[2-[2-[2-[2-(2,3,3,4,4,5-hexafluorocyclopenten-1-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopenten-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopentene has a molecular weight of 926.56 g/mol, XLogP of 7.19, 28 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,3,4,4,5,5-heptafluoro-2-[2-[2-[2-[2-[3,3,4,4,5,5-hexafluoro-2-[2-[2-[2-[2-(2,3,3,4,4,5-hexafluorocyclopenten-1-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopenten-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]cyclopentene is sourced from PubChem (CID 176591332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).