3,5-diethyl-4-fluoro-4-methylheptane;3,5-diethyl-4-fluoro-3,4,5-trimethylheptane;2,2-dimethylpropane;3-fluoro-2,3-dimethylpentane;1-fluoro-1-methylcyclohexane;4-fluoro-4-methylheptane;1-fluoro-1,4,4-trimethylcyclohexane;4-fluoro-2,4,6-trimethyl-3,5-di(propan-2-yl)heptane;3-fluoro-2,3,4-trimethylpentane;3-methyl-3-(trifluoromethyl)pentane;2,3,4-trimethyl-3-(trifluoromethyl)pentane

C102H208F14 — CID 167577471

About 3,5-diethyl-4-fluoro-4-methylheptane;3,5-diethyl-4-fluoro-3,4,5-trimethylheptane;2,2-dimethylpropane;3-fluoro-2,3-dimethylpentane;1-fluoro-1-methylcyclohexane;4-fluoro-4-methylheptane;1-fluoro-1,4,4-trimethylcyclohexane;4-fluoro-2,4,6-trimethyl-3,5-di(propan-2-yl)heptane;3-fluoro-2,3,4-trimethylpentane;3-methyl-3-(trifluoromethyl)pentane;2,3,4-trimethyl-3-(trifluoromethyl)pentane

3,5-diethyl-4-fluoro-4-methylheptane;3,5-diethyl-4-fluoro-3,4,5-trimethylheptane;2,2-dimethylpropane;3-fluoro-2,3-dimethylpentane;1-fluoro-1-methylcyclohexane;4-fluoro-4-methylheptane;1-fluoro-1,4,4-trimethylcyclohexane;4-fluoro-2,4,6-trimethyl-3,5-di(propan-2-yl)heptane;3-fluoro-2,3,4-trimethylpentane;3-methyl-3-(trifluoromethyl)pentane;2,3,4-trimethyl-3-(trifluoromethyl)pentane (PubChem CID 167577471) has the molecular formula C102H208F14 and a molecular weight of 1700.76 g/mol. Its IUPAC name is 3,5-diethyl-4-fluoro-4-methylheptane;3,5-diethyl-4-fluoro-3,4,5-trimethylheptane;2,2-dimethylpropane;3-fluoro-2,3-dimethylpentane;1-fluoro-1-methylcyclohexane;4-fluoro-4-methylheptane;1-fluoro-1,4,4-trimethylcyclohexane;4-fluoro-2,4,6-trimethyl-3,5-di(propan-2-yl)heptane;3-fluoro-2,3,4-trimethylpentane;3-methyl-3-(trifluoromethyl)pentane;2,3,4-trimethyl-3-(trifluoromethyl)pentane.

Molecular Properties

• Compound Name: 3,5-diethyl-4-fluoro-4-methylheptane;3,5-diethyl-4-fluoro-3,4,5-trimethylheptane;2,2-dimethylpropane;3-fluoro-2,3-dimethylpentane;1-fluoro-1-methylcyclohexane;4-fluoro-4-methylheptane;1-fluoro-1,4,4-trimethylcyclohexane;4-fluoro-2,4,6-trimethyl-3,5-di(propan-2-yl)heptane;3-fluoro-2,3,4-trimethylpentane;3-methyl-3-(trifluoromethyl)pentane;2,3,4-trimethyl-3-(trifluoromethyl)pentane
• PubChem CID: 167577471
• Molecular Formula: C102H208F14
• Molecular Weight: 1700.76 g/mol
• Exact Mass: 1699.61
• IUPAC Name: 3,5-diethyl-4-fluoro-4-methylheptane;3,5-diethyl-4-fluoro-3,4,5-trimethylheptane;2,2-dimethylpropane;3-fluoro-2,3-dimethylpentane;1-fluoro-1-methylcyclohexane;4-fluoro-4-methylheptane;1-fluoro-1,4,4-trimethylcyclohexane;4-fluoro-2,4,6-trimethyl-3,5-di(propan-2-yl)heptane;3-fluoro-2,3,4-trimethylpentane;3-methyl-3-(trifluoromethyl)pentane;2,3,4-trimethyl-3-(trifluoromethyl)pentane
• SMILES: CC(C)(C)C.CC(C)C(C(C)C)C(C)(F)C(C(C)C)C(C)C.CC(C)C(C)(C(C)C)C(F)(F)F.CC(C)C(C)(F)C(C)C.CC1(C)CCC(C)(F)CC1.CC1(F)CCCCC1.CCC(C)(CC)C(C)(F)C(C)(CC)CC.CCC(C)(CC)C(F)(F)F.CCC(C)(F)C(C)C.CCC(CC)C(C)(F)C(CC)CC.CCCC(C)(F)CCC
• InChI: InChI=1S/C16H33F.C14H29F.C12H25F.C9H17F3.C9H17F.2C8H17F.C7H13F3.C7H13F.C7H15F.C5H12/c1-10(2)14(11(3)4)16(9,17)15(12(5)6)13(7)8;1-8-12(5,9-2)14(7,15)13(6,10-3)11-4;1-6-10(7-2)12(5,13)11(8-3)9-4;1-6(2)8(5,7(3)4)9(10,11)12;1-8(2)4-6-9(3,10)7-5-8;1-6(2)8(5,9)7(3)4;1-4-6-8(3,9)7-5-2;1-4-6(3,5-2)7(8,9)10;1-7(8)5-3-2-4-6-7;1-5-7(4,8)6(2)3;1-5(2,3)4/h10-15H,1-9H3;8-11H2,1-7H3;10-11H,6-9H2,1-5H3;6-7H,1-5H3;4-7H2,1-3H3;6-7H,1-5H3;4-7H2,1-3H3;4-5H2,1-3H3;2-6H2,1H3;6H,5H2,1-4H3;1-4H3
• InChIKey: GSQYGGDDVDFOTM-UHFFFAOYSA-N
• XLogP: 39.94
• TPSA: 0.00 Ų
• Rotatable Bonds: 30
• Heavy Atoms: 116
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1700.76
LogP ≤ 5	39.94
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Frequently Asked Questions

What is the IUPAC name of 3,5-diethyl-4-fluoro-4-methylheptane;3,5-diethyl-4-fluoro-3,4,5-trimethylheptane;2,2-dimethylpropane;3-fluoro-2,3-dimethylpentane;1-fluoro-1-methylcyclohexane;4-fluoro-4-methylheptane;1-fluoro-1,4,4-trimethylcyclohexane;4-fluoro-2,4,6-trimethyl-3,5-di(propan-2-yl)heptane;3-fluoro-2,3,4-trimethylpentane;3-methyl-3-(trifluoromethyl)pentane;2,3,4-trimethyl-3-(trifluoromethyl)pentane?

The IUPAC name of 3,5-diethyl-4-fluoro-4-methylheptane;3,5-diethyl-4-fluoro-3,4,5-trimethylheptane;2,2-dimethylpropane;3-fluoro-2,3-dimethylpentane;1-fluoro-1-methylcyclohexane;4-fluoro-4-methylheptane;1-fluoro-1,4,4-trimethylcyclohexane;4-fluoro-2,4,6-trimethyl-3,5-di(propan-2-yl)heptane;3-fluoro-2,3,4-trimethylpentane;3-methyl-3-(trifluoromethyl)pentane;2,3,4-trimethyl-3-(trifluoromethyl)pentane (CID 167577471) is 3,5-diethyl-4-fluoro-4-methylheptane;3,5-diethyl-4-fluoro-3,4,5-trimethylheptane;2,2-dimethylpropane;3-fluoro-2,3-dimethylpentane;1-fluoro-1-methylcyclohexane;4-fluoro-4-methylheptane;1-fluoro-1,4,4-trimethylcyclohexane;4-fluoro-2,4,6-trimethyl-3,5-di(propan-2-yl)heptane;3-fluoro-2,3,4-trimethylpentane;3-methyl-3-(trifluoromethyl)pentane;2,3,4-trimethyl-3-(trifluoromethyl)pentane.

What is the SMILES notation for 3,5-diethyl-4-fluoro-4-methylheptane;3,5-diethyl-4-fluoro-3,4,5-trimethylheptane;2,2-dimethylpropane;3-fluoro-2,3-dimethylpentane;1-fluoro-1-methylcyclohexane;4-fluoro-4-methylheptane;1-fluoro-1,4,4-trimethylcyclohexane;4-fluoro-2,4,6-trimethyl-3,5-di(propan-2-yl)heptane;3-fluoro-2,3,4-trimethylpentane;3-methyl-3-(trifluoromethyl)pentane;2,3,4-trimethyl-3-(trifluoromethyl)pentane?

The canonical SMILES for 3,5-diethyl-4-fluoro-4-methylheptane;3,5-diethyl-4-fluoro-3,4,5-trimethylheptane;2,2-dimethylpropane;3-fluoro-2,3-dimethylpentane;1-fluoro-1-methylcyclohexane;4-fluoro-4-methylheptane;1-fluoro-1,4,4-trimethylcyclohexane;4-fluoro-2,4,6-trimethyl-3,5-di(propan-2-yl)heptane;3-fluoro-2,3,4-trimethylpentane;3-methyl-3-(trifluoromethyl)pentane;2,3,4-trimethyl-3-(trifluoromethyl)pentane is CC(C)(C)C.CC(C)C(C(C)C)C(C)(F)C(C(C)C)C(C)C.CC(C)C(C)(C(C)C)C(F)(F)F.CC(C)C(C)(F)C(C)C.CC1(C)CCC(C)(F)CC1.CC1(F)CCCCC1.CCC(C)(CC)C(C)(F)C(C)(CC)CC.CCC(C)(CC)C(F)(F)F.CCC(C)(F)C(C)C.CCC(CC)C(C)(F)C(CC)CC.CCCC(C)(F)CCC.

What is the InChIKey of 3,5-diethyl-4-fluoro-4-methylheptane;3,5-diethyl-4-fluoro-3,4,5-trimethylheptane;2,2-dimethylpropane;3-fluoro-2,3-dimethylpentane;1-fluoro-1-methylcyclohexane;4-fluoro-4-methylheptane;1-fluoro-1,4,4-trimethylcyclohexane;4-fluoro-2,4,6-trimethyl-3,5-di(propan-2-yl)heptane;3-fluoro-2,3,4-trimethylpentane;3-methyl-3-(trifluoromethyl)pentane;2,3,4-trimethyl-3-(trifluoromethyl)pentane?

The InChIKey is GSQYGGDDVDFOTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33F.C14H29F.C12H25F.C9H17F3.C9H17F.2C8H17F.C7H13F3.C7H13F.C7H15F.C5H12/c1-10(2)14(11(3)4)16(9,17)15(12(5)6)13(7)8;1-8-12(5,9-2)14(7,15)13(6,10-3)11-4;1-6-10(7-2)12(5,13)11(8-3)9-4;1-6(2)8(5,7(3)4)9(10,11)12;1-8(2)4-6-9(3,10)7-5-8;1-6(2)8(5,9)7(3)4;1-4-6-8(3,9)7-5-2;1-4-6(3,5-2)7(8,9)10;1-7(8)5-3-2-4-6-7;1-5-7(4,8)6(2)3;1-5(2,3)4/h10-15H,1-9H3;8-11H2,1-7H3;10-11H,6-9H2,1-5H3;6-7H,1-5H3;4-7H2,1-3H3;6-7H,1-5H3;4-7H2,1-3H3;4-5H2,1-3H3;2-6H2,1H3;6H,5H2,1-4H3;1-4H3.

What are the key properties of 3,5-diethyl-4-fluoro-4-methylheptane;3,5-diethyl-4-fluoro-3,4,5-trimethylheptane;2,2-dimethylpropane;3-fluoro-2,3-dimethylpentane;1-fluoro-1-methylcyclohexane;4-fluoro-4-methylheptane;1-fluoro-1,4,4-trimethylcyclohexane;4-fluoro-2,4,6-trimethyl-3,5-di(propan-2-yl)heptane;3-fluoro-2,3,4-trimethylpentane;3-methyl-3-(trifluoromethyl)pentane;2,3,4-trimethyl-3-(trifluoromethyl)pentane?

3,5-diethyl-4-fluoro-4-methylheptane;3,5-diethyl-4-fluoro-3,4,5-trimethylheptane;2,2-dimethylpropane;3-fluoro-2,3-dimethylpentane;1-fluoro-1-methylcyclohexane;4-fluoro-4-methylheptane;1-fluoro-1,4,4-trimethylcyclohexane;4-fluoro-2,4,6-trimethyl-3,5-di(propan-2-yl)heptane;3-fluoro-2,3,4-trimethylpentane;3-methyl-3-(trifluoromethyl)pentane;2,3,4-trimethyl-3-(trifluoromethyl)pentane has a molecular weight of 1700.76 g/mol, XLogP of 39.94, 30 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for 3,5-diethyl-4-fluoro-4-methylheptane;3,5-diethyl-4-fluoro-3,4,5-trimethylheptane;2,2-dimethylpropane;3-fluoro-2,3-dimethylpentane;1-fluoro-1-methylcyclohexane;4-fluoro-4-methylheptane;1-fluoro-1,4,4-trimethylcyclohexane;4-fluoro-2,4,6-trimethyl-3,5-di(propan-2-yl)heptane;3-fluoro-2,3,4-trimethylpentane;3-methyl-3-(trifluoromethyl)pentane;2,3,4-trimethyl-3-(trifluoromethyl)pentane is sourced from PubChem (CID 167577471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).