nonakis(cyclohexane);1,3-difluoro-2,5-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;1,3-difluoro-2,6-dimethylnaphthalene;5,7-difluoro-6-methyl-1,2,3,4-tetrahydronaphthalene;1,4-dimethylbicyclo[2.2.2]octane;1,4-dimethylcyclohexane;2,5-dimethyl-1,3-dioxane;2,6-dimethylnaphthalene;bis(2,5-dimethyloxane);bis(2-fluoro-1,4-dimethylbenzene);fluoromethane;1-fluoropropane;methane;propane;prop-1-ene;1,2,8-trifluoro-3,7-dimethylnaphthalene;1,4-xylene

C208H368F16O4 — CID 158810475

About nonakis(cyclohexane);1,3-difluoro-2,5-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;1,3-difluoro-2,6-dimethylnaphthalene;5,7-difluoro-6-methyl-1,2,3,4-tetrahydronaphthalene;1,4-dimethylbicyclo[2.2.2]octane;1,4-dimethylcyclohexane;2,5-dimethyl-1,3-dioxane;2,6-dimethylnaphthalene;bis(2,5-dimethyloxane);bis(2-fluoro-1,4-dimethylbenzene);fluoromethane;1-fluoropropane;methane;propane;prop-1-ene;1,2,8-trifluoro-3,7-dimethylnaphthalene;1,4-xylene

nonakis(cyclohexane);1,3-difluoro-2,5-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;1,3-difluoro-2,6-dimethylnaphthalene;5,7-difluoro-6-methyl-1,2,3,4-tetrahydronaphthalene;1,4-dimethylbicyclo[2.2.2]octane;1,4-dimethylcyclohexane;2,5-dimethyl-1,3-dioxane;2,6-dimethylnaphthalene;bis(2,5-dimethyloxane);bis(2-fluoro-1,4-dimethylbenzene);fluoromethane;1-fluoropropane;methane;propane;prop-1-ene;1,2,8-trifluoro-3,7-dimethylnaphthalene;1,4-xylene (PubChem CID 158810475) has the molecular formula C208H368F16O4 and a molecular weight of 3237.20 g/mol. Its IUPAC name is nonakis(cyclohexane);1,3-difluoro-2,5-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;1,3-difluoro-2,6-dimethylnaphthalene;5,7-difluoro-6-methyl-1,2,3,4-tetrahydronaphthalene;1,4-dimethylbicyclo[2.2.2]octane;1,4-dimethylcyclohexane;2,5-dimethyl-1,3-dioxane;2,6-dimethylnaphthalene;bis(2,5-dimethyloxane);bis(2-fluoro-1,4-dimethylbenzene);fluoromethane;1-fluoropropane;methane;propane;prop-1-ene;1,2,8-trifluoro-3,7-dimethylnaphthalene;1,4-xylene.

Molecular Properties

• Compound Name: nonakis(cyclohexane);1,3-difluoro-2,5-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;1,3-difluoro-2,6-dimethylnaphthalene;5,7-difluoro-6-methyl-1,2,3,4-tetrahydronaphthalene;1,4-dimethylbicyclo[2.2.2]octane;1,4-dimethylcyclohexane;2,5-dimethyl-1,3-dioxane;2,6-dimethylnaphthalene;bis(2,5-dimethyloxane);bis(2-fluoro-1,4-dimethylbenzene);fluoromethane;1-fluoropropane;methane;propane;prop-1-ene;1,2,8-trifluoro-3,7-dimethylnaphthalene;1,4-xylene
• PubChem CID: 158810475
• Molecular Formula: C208H368F16O4
• Molecular Weight: 3237.20 g/mol
• Exact Mass: 3234.83
• IUPAC Name: nonakis(cyclohexane);1,3-difluoro-2,5-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;1,3-difluoro-2,6-dimethylnaphthalene;5,7-difluoro-6-methyl-1,2,3,4-tetrahydronaphthalene;1,4-dimethylbicyclo[2.2.2]octane;1,4-dimethylcyclohexane;2,5-dimethyl-1,3-dioxane;2,6-dimethylnaphthalene;bis(2,5-dimethyloxane);bis(2-fluoro-1,4-dimethylbenzene);fluoromethane;1-fluoropropane;methane;propane;prop-1-ene;1,2,8-trifluoro-3,7-dimethylnaphthalene;1,4-xylene
• SMILES: C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C1CCCCC1.C1CCCCC1.C1CCCCC1.C1CCCCC1.C1CCCCC1.C1CCCCC1.C1CCCCC1.C1CCCCC1.C1CCCCC1.C=CC.CC12CCC(C)(CC1)CC2.CC1CCC(C)CC1.CC1CCC(C)OC1.CC1CCC(C)OC1.CC1COC(C)OC1.CCC.CCCF.CF.CF.Cc1c(F)cc2c(c1F)CCCC2.Cc1cc(F)c(C)c(F)c1.Cc1cc2ccc(C)c(F)c2c(F)c1F.Cc1ccc(C)c(F)c1.Cc1ccc(C)c(F)c1.Cc1ccc(C)c(F)c1F.Cc1ccc(C)cc1.Cc1ccc2c(F)c(C)c(F)cc2c1.Cc1ccc2cc(C)ccc2c1
• InChI: InChI=1S/C12H9F3.C12H10F2.C12H12.C11H12F2.C10H18.2C8H8F2.2C8H9F.C8H16.C8H10.2C7H14O.C6H12O2.9C6H12.C3H7F.C3H8.C3H6.2CH3F.18CH4/c1-6-3-4-8-5-7(2)11(14)12(15)9(8)10(6)13;1-7-3-4-10-9(5-7)6-11(13)8(2)12(10)14;1-9-3-5-12-8-10(2)4-6-11(12)7-9;1-7-10(12)6-8-4-2-3-5-9(8)11(7)13;1-9-3-6-10(2,7-4-9)8-5-9;1-5-3-7(9)6(2)8(10)4-5;1-5-3-4-6(2)8(10)7(5)9;2*1-6-3-4-7(2)8(9)5-6;2*1-7-3-5-8(2)6-4-7;2*1-6-3-4-7(2)8-5-6;1-5-3-7-6(2)8-4-5;9*1-2-4-6-5-3-1;1-2-3-4;2*1-3-2;2*1-2;;;;;;;;;;;;;;;;;;/h3-5H,1-2H3;3-6H,1-2H3;3-8H,1-2H3;6H,2-5H2,1H3;3-8H2,1-2H3;2*3-4H,1-2H3;2*3-5H,1-2H3;7-8H,3-6H2,1-2H3;3-6H,1-2H3;2*6-7H,3-5H2,1-2H3;5-6H,3-4H2,1-2H3;9*1-6H2;2-3H2,1H3;3H2,1-2H3;3H,1H2,2H3;2*1H3;18*1H4
• InChIKey: IUPSPKCICOZBJX-UHFFFAOYSA-N
• XLogP: 75.09
• TPSA: 36.92 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 1
• Heavy Atoms: 228
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	3237.20
LogP ≤ 5	75.09
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of nonakis(cyclohexane);1,3-difluoro-2,5-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;1,3-difluoro-2,6-dimethylnaphthalene;5,7-difluoro-6-methyl-1,2,3,4-tetrahydronaphthalene;1,4-dimethylbicyclo[2.2.2]octane;1,4-dimethylcyclohexane;2,5-dimethyl-1,3-dioxane;2,6-dimethylnaphthalene;bis(2,5-dimethyloxane);bis(2-fluoro-1,4-dimethylbenzene);fluoromethane;1-fluoropropane;methane;propane;prop-1-ene;1,2,8-trifluoro-3,7-dimethylnaphthalene;1,4-xylene?

The IUPAC name of nonakis(cyclohexane);1,3-difluoro-2,5-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;1,3-difluoro-2,6-dimethylnaphthalene;5,7-difluoro-6-methyl-1,2,3,4-tetrahydronaphthalene;1,4-dimethylbicyclo[2.2.2]octane;1,4-dimethylcyclohexane;2,5-dimethyl-1,3-dioxane;2,6-dimethylnaphthalene;bis(2,5-dimethyloxane);bis(2-fluoro-1,4-dimethylbenzene);fluoromethane;1-fluoropropane;methane;propane;prop-1-ene;1,2,8-trifluoro-3,7-dimethylnaphthalene;1,4-xylene (CID 158810475) is nonakis(cyclohexane);1,3-difluoro-2,5-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;1,3-difluoro-2,6-dimethylnaphthalene;5,7-difluoro-6-methyl-1,2,3,4-tetrahydronaphthalene;1,4-dimethylbicyclo[2.2.2]octane;1,4-dimethylcyclohexane;2,5-dimethyl-1,3-dioxane;2,6-dimethylnaphthalene;bis(2,5-dimethyloxane);bis(2-fluoro-1,4-dimethylbenzene);fluoromethane;1-fluoropropane;methane;propane;prop-1-ene;1,2,8-trifluoro-3,7-dimethylnaphthalene;1,4-xylene.

What is the SMILES notation for nonakis(cyclohexane);1,3-difluoro-2,5-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;1,3-difluoro-2,6-dimethylnaphthalene;5,7-difluoro-6-methyl-1,2,3,4-tetrahydronaphthalene;1,4-dimethylbicyclo[2.2.2]octane;1,4-dimethylcyclohexane;2,5-dimethyl-1,3-dioxane;2,6-dimethylnaphthalene;bis(2,5-dimethyloxane);bis(2-fluoro-1,4-dimethylbenzene);fluoromethane;1-fluoropropane;methane;propane;prop-1-ene;1,2,8-trifluoro-3,7-dimethylnaphthalene;1,4-xylene?

The canonical SMILES for nonakis(cyclohexane);1,3-difluoro-2,5-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;1,3-difluoro-2,6-dimethylnaphthalene;5,7-difluoro-6-methyl-1,2,3,4-tetrahydronaphthalene;1,4-dimethylbicyclo[2.2.2]octane;1,4-dimethylcyclohexane;2,5-dimethyl-1,3-dioxane;2,6-dimethylnaphthalene;bis(2,5-dimethyloxane);bis(2-fluoro-1,4-dimethylbenzene);fluoromethane;1-fluoropropane;methane;propane;prop-1-ene;1,2,8-trifluoro-3,7-dimethylnaphthalene;1,4-xylene is C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C1CCCCC1.C1CCCCC1.C1CCCCC1.C1CCCCC1.C1CCCCC1.C1CCCCC1.C1CCCCC1.C1CCCCC1.C1CCCCC1.C=CC.CC12CCC(C)(CC1)CC2.CC1CCC(C)CC1.CC1CCC(C)OC1.CC1CCC(C)OC1.CC1COC(C)OC1.CCC.CCCF.CF.CF.Cc1c(F)cc2c(c1F)CCCC2.Cc1cc(F)c(C)c(F)c1.Cc1cc2ccc(C)c(F)c2c(F)c1F.Cc1ccc(C)c(F)c1.Cc1ccc(C)c(F)c1.Cc1ccc(C)c(F)c1F.Cc1ccc(C)cc1.Cc1ccc2c(F)c(C)c(F)cc2c1.Cc1ccc2cc(C)ccc2c1.

What is the InChIKey of nonakis(cyclohexane);1,3-difluoro-2,5-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;1,3-difluoro-2,6-dimethylnaphthalene;5,7-difluoro-6-methyl-1,2,3,4-tetrahydronaphthalene;1,4-dimethylbicyclo[2.2.2]octane;1,4-dimethylcyclohexane;2,5-dimethyl-1,3-dioxane;2,6-dimethylnaphthalene;bis(2,5-dimethyloxane);bis(2-fluoro-1,4-dimethylbenzene);fluoromethane;1-fluoropropane;methane;propane;prop-1-ene;1,2,8-trifluoro-3,7-dimethylnaphthalene;1,4-xylene?

The InChIKey is IUPSPKCICOZBJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9F3.C12H10F2.C12H12.C11H12F2.C10H18.2C8H8F2.2C8H9F.C8H16.C8H10.2C7H14O.C6H12O2.9C6H12.C3H7F.C3H8.C3H6.2CH3F.18CH4/c1-6-3-4-8-5-7(2)11(14)12(15)9(8)10(6)13;1-7-3-4-10-9(5-7)6-11(13)8(2)12(10)14;1-9-3-5-12-8-10(2)4-6-11(12)7-9;1-7-10(12)6-8-4-2-3-5-9(8)11(7)13;1-9-3-6-10(2,7-4-9)8-5-9;1-5-3-7(9)6(2)8(10)4-5;1-5-3-4-6(2)8(10)7(5)9;2*1-6-3-4-7(2)8(9)5-6;2*1-7-3-5-8(2)6-4-7;2*1-6-3-4-7(2)8-5-6;1-5-3-7-6(2)8-4-5;9*1-2-4-6-5-3-1;1-2-3-4;2*1-3-2;2*1-2;;;;;;;;;;;;;;;;;;/h3-5H,1-2H3;3-6H,1-2H3;3-8H,1-2H3;6H,2-5H2,1H3;3-8H2,1-2H3;2*3-4H,1-2H3;2*3-5H,1-2H3;7-8H,3-6H2,1-2H3;3-6H,1-2H3;2*6-7H,3-5H2,1-2H3;5-6H,3-4H2,1-2H3;9*1-6H2;2-3H2,1H3;3H2,1-2H3;3H,1H2,2H3;2*1H3;18*1H4.

What are the key properties of nonakis(cyclohexane);1,3-difluoro-2,5-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;1,3-difluoro-2,6-dimethylnaphthalene;5,7-difluoro-6-methyl-1,2,3,4-tetrahydronaphthalene;1,4-dimethylbicyclo[2.2.2]octane;1,4-dimethylcyclohexane;2,5-dimethyl-1,3-dioxane;2,6-dimethylnaphthalene;bis(2,5-dimethyloxane);bis(2-fluoro-1,4-dimethylbenzene);fluoromethane;1-fluoropropane;methane;propane;prop-1-ene;1,2,8-trifluoro-3,7-dimethylnaphthalene;1,4-xylene?

nonakis(cyclohexane);1,3-difluoro-2,5-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;1,3-difluoro-2,6-dimethylnaphthalene;5,7-difluoro-6-methyl-1,2,3,4-tetrahydronaphthalene;1,4-dimethylbicyclo[2.2.2]octane;1,4-dimethylcyclohexane;2,5-dimethyl-1,3-dioxane;2,6-dimethylnaphthalene;bis(2,5-dimethyloxane);bis(2-fluoro-1,4-dimethylbenzene);fluoromethane;1-fluoropropane;methane;propane;prop-1-ene;1,2,8-trifluoro-3,7-dimethylnaphthalene;1,4-xylene has a molecular weight of 3237.20 g/mol, XLogP of 75.09, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for nonakis(cyclohexane);1,3-difluoro-2,5-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;1,3-difluoro-2,6-dimethylnaphthalene;5,7-difluoro-6-methyl-1,2,3,4-tetrahydronaphthalene;1,4-dimethylbicyclo[2.2.2]octane;1,4-dimethylcyclohexane;2,5-dimethyl-1,3-dioxane;2,6-dimethylnaphthalene;bis(2,5-dimethyloxane);bis(2-fluoro-1,4-dimethylbenzene);fluoromethane;1-fluoropropane;methane;propane;prop-1-ene;1,2,8-trifluoro-3,7-dimethylnaphthalene;1,4-xylene is sourced from PubChem (CID 158810475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).