bis(1,1-dimethylcyclopentane);1-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-1-(trifluoromethyl)cyclohexane;1-(1,1,2,2,3,3,3-heptafluoropropyl)-1-(trifluoromethyl)cyclohexane;methylcyclopentane;1,1,1,2,2-pentafluoroethane;1,1,2,2,2-pentafluoroethylcyclohexane;hexahydrofluoride

C50H78F36 — CID 161087762

About bis(1,1-dimethylcyclopentane);1-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-1-(trifluoromethyl)cyclohexane;1-(1,1,2,2,3,3,3-heptafluoropropyl)-1-(trifluoromethyl)cyclohexane;methylcyclopentane;1,1,1,2,2-pentafluoroethane;1,1,2,2,2-pentafluoroethylcyclohexane;hexahydrofluoride

bis(1,1-dimethylcyclopentane);1-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-1-(trifluoromethyl)cyclohexane;1-(1,1,2,2,3,3,3-heptafluoropropyl)-1-(trifluoromethyl)cyclohexane;methylcyclopentane;1,1,1,2,2-pentafluoroethane;1,1,2,2,2-pentafluoroethylcyclohexane;hexahydrofluoride (PubChem CID 161087762) has the molecular formula C50H78F36 and a molecular weight of 1363.10 g/mol. Its IUPAC name is bis(1,1-dimethylcyclopentane);1-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-1-(trifluoromethyl)cyclohexane;1-(1,1,2,2,3,3,3-heptafluoropropyl)-1-(trifluoromethyl)cyclohexane;methylcyclopentane;1,1,1,2,2-pentafluoroethane;1,1,2,2,2-pentafluoroethylcyclohexane;hexahydrofluoride.

Molecular Properties

• Compound Name: bis(1,1-dimethylcyclopentane);1-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-1-(trifluoromethyl)cyclohexane;1-(1,1,2,2,3,3,3-heptafluoropropyl)-1-(trifluoromethyl)cyclohexane;methylcyclopentane;1,1,1,2,2-pentafluoroethane;1,1,2,2,2-pentafluoroethylcyclohexane;hexahydrofluoride
• PubChem CID: 161087762
• Molecular Formula: C50H78F36
• Molecular Weight: 1363.10 g/mol
• Exact Mass: 1362.55
• IUPAC Name: bis(1,1-dimethylcyclopentane);1-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-1-(trifluoromethyl)cyclohexane;1-(1,1,2,2,3,3,3-heptafluoropropyl)-1-(trifluoromethyl)cyclohexane;methylcyclopentane;1,1,1,2,2-pentafluoroethane;1,1,2,2,2-pentafluoroethylcyclohexane;hexahydrofluoride
• SMILES: CC1(C)CCCC1.CC1(C)CCCC1.CC1CCCC1.F.F.F.F.F.F.FC(F)(F)C(F)(F)C(F)(F)C1(C(F)(F)F)CCCCC1.FC(F)(F)C(F)(F)C1CCCCC1.FC(F)(F)C1(C(F)(C(F)(F)F)C(F)(F)F)CCCCC1.FC(F)C(F)(F)F
• InChI: InChI=1S/2C10H10F10.C8H11F5.2C7H14.C6H12.C2HF5.6FH/c11-7(12,8(13,14)10(18,19)20)6(9(15,16)17)4-2-1-3-5-6;11-7(9(15,16)17,10(18,19)20)6(8(12,13)14)4-2-1-3-5-6;9-7(10,8(11,12)13)6-4-2-1-3-5-6;2*1-7(2)5-3-4-6-7;1-6-4-2-3-5-6;3-1(4)2(5,6)7;;;;;;/h2*1-5H2;6H,1-5H2;2*3-6H2,1-2H3;6H,2-5H2,1H3;1H;6*1H
• InChIKey: UGTHAOGZQWRGIA-UHFFFAOYSA-N
• XLogP: 24.53
• TPSA: 0.00 Ų
• Rotatable Bonds: 4
• Heavy Atoms: 86
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1363.10
LogP ≤ 5	24.53
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of bis(1,1-dimethylcyclopentane);1-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-1-(trifluoromethyl)cyclohexane;1-(1,1,2,2,3,3,3-heptafluoropropyl)-1-(trifluoromethyl)cyclohexane;methylcyclopentane;1,1,1,2,2-pentafluoroethane;1,1,2,2,2-pentafluoroethylcyclohexane;hexahydrofluoride?

The IUPAC name of bis(1,1-dimethylcyclopentane);1-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-1-(trifluoromethyl)cyclohexane;1-(1,1,2,2,3,3,3-heptafluoropropyl)-1-(trifluoromethyl)cyclohexane;methylcyclopentane;1,1,1,2,2-pentafluoroethane;1,1,2,2,2-pentafluoroethylcyclohexane;hexahydrofluoride (CID 161087762) is bis(1,1-dimethylcyclopentane);1-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-1-(trifluoromethyl)cyclohexane;1-(1,1,2,2,3,3,3-heptafluoropropyl)-1-(trifluoromethyl)cyclohexane;methylcyclopentane;1,1,1,2,2-pentafluoroethane;1,1,2,2,2-pentafluoroethylcyclohexane;hexahydrofluoride.

What is the SMILES notation for bis(1,1-dimethylcyclopentane);1-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-1-(trifluoromethyl)cyclohexane;1-(1,1,2,2,3,3,3-heptafluoropropyl)-1-(trifluoromethyl)cyclohexane;methylcyclopentane;1,1,1,2,2-pentafluoroethane;1,1,2,2,2-pentafluoroethylcyclohexane;hexahydrofluoride?

The canonical SMILES for bis(1,1-dimethylcyclopentane);1-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-1-(trifluoromethyl)cyclohexane;1-(1,1,2,2,3,3,3-heptafluoropropyl)-1-(trifluoromethyl)cyclohexane;methylcyclopentane;1,1,1,2,2-pentafluoroethane;1,1,2,2,2-pentafluoroethylcyclohexane;hexahydrofluoride is CC1(C)CCCC1.CC1(C)CCCC1.CC1CCCC1.F.F.F.F.F.F.FC(F)(F)C(F)(F)C(F)(F)C1(C(F)(F)F)CCCCC1.FC(F)(F)C(F)(F)C1CCCCC1.FC(F)(F)C1(C(F)(C(F)(F)F)C(F)(F)F)CCCCC1.FC(F)C(F)(F)F.

What is the InChIKey of bis(1,1-dimethylcyclopentane);1-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-1-(trifluoromethyl)cyclohexane;1-(1,1,2,2,3,3,3-heptafluoropropyl)-1-(trifluoromethyl)cyclohexane;methylcyclopentane;1,1,1,2,2-pentafluoroethane;1,1,2,2,2-pentafluoroethylcyclohexane;hexahydrofluoride?

The InChIKey is UGTHAOGZQWRGIA-UHFFFAOYSA-N. The full InChI is InChI=1S/2C10H10F10.C8H11F5.2C7H14.C6H12.C2HF5.6FH/c11-7(12,8(13,14)10(18,19)20)6(9(15,16)17)4-2-1-3-5-6;11-7(9(15,16)17,10(18,19)20)6(8(12,13)14)4-2-1-3-5-6;9-7(10,8(11,12)13)6-4-2-1-3-5-6;2*1-7(2)5-3-4-6-7;1-6-4-2-3-5-6;3-1(4)2(5,6)7;;;;;;/h2*1-5H2;6H,1-5H2;2*3-6H2,1-2H3;6H,2-5H2,1H3;1H;6*1H.

What are the key properties of bis(1,1-dimethylcyclopentane);1-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-1-(trifluoromethyl)cyclohexane;1-(1,1,2,2,3,3,3-heptafluoropropyl)-1-(trifluoromethyl)cyclohexane;methylcyclopentane;1,1,1,2,2-pentafluoroethane;1,1,2,2,2-pentafluoroethylcyclohexane;hexahydrofluoride?

bis(1,1-dimethylcyclopentane);1-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-1-(trifluoromethyl)cyclohexane;1-(1,1,2,2,3,3,3-heptafluoropropyl)-1-(trifluoromethyl)cyclohexane;methylcyclopentane;1,1,1,2,2-pentafluoroethane;1,1,2,2,2-pentafluoroethylcyclohexane;hexahydrofluoride has a molecular weight of 1363.10 g/mol, XLogP of 24.53, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for bis(1,1-dimethylcyclopentane);1-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-1-(trifluoromethyl)cyclohexane;1-(1,1,2,2,3,3,3-heptafluoropropyl)-1-(trifluoromethyl)cyclohexane;methylcyclopentane;1,1,1,2,2-pentafluoroethane;1,1,2,2,2-pentafluoroethylcyclohexane;hexahydrofluoride is sourced from PubChem (CID 161087762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).