1,1,1,2,3,3-hexafluoro-4,4-dimethylpentane

C7H10F6 — CID 10727045

IUPAC1,1,1,2,3,3-hexafluoro-4,4-dimethylpentane
SMILESCC(C)(C)C(F)(F)C(F)C(F)(F)F
InChIInChI=1S/C7H10F6/c1-5(2,3)6(9,10)4(8)7(11,12)13/h4H,1-3H3
InChIKeyMRHLZYMLHLVIMO-UHFFFAOYSA-N
MW208.15 g/mol
LogP3.57
Rot. Bonds1

About 1,1,1,2,3,3-hexafluoro-4,4-dimethylpentane

1,1,1,2,3,3-hexafluoro-4,4-dimethylpentane (PubChem CID 10727045) has the molecular formula C7H10F6 and a molecular weight of 208.15 g/mol. Its IUPAC name is 1,1,1,2,3,3-hexafluoro-4,4-dimethylpentane.

Molecular Properties

Compound Name1,1,1,2,3,3-hexafluoro-4,4-dimethylpentane
PubChem CID10727045
Molecular FormulaC7H10F6
Molecular Weight208.15 g/mol
Exact Mass208.07
IUPAC Name1,1,1,2,3,3-hexafluoro-4,4-dimethylpentane
SMILESCC(C)(C)C(F)(F)C(F)C(F)(F)F
InChIInChI=1S/C7H10F6/c1-5(2,3)6(9,10)4(8)7(11,12)13/h4H,1-3H3
InChIKeyMRHLZYMLHLVIMO-UHFFFAOYSA-N
XLogP3.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.15
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,1,1,2,3,3-hexafluoro-4,4-dimethylpentane?
The IUPAC name of 1,1,1,2,3,3-hexafluoro-4,4-dimethylpentane (CID 10727045) is 1,1,1,2,3,3-hexafluoro-4,4-dimethylpentane.
What is the SMILES notation for 1,1,1,2,3,3-hexafluoro-4,4-dimethylpentane?
The canonical SMILES for 1,1,1,2,3,3-hexafluoro-4,4-dimethylpentane is CC(C)(C)C(F)(F)C(F)C(F)(F)F.
What is the InChIKey of 1,1,1,2,3,3-hexafluoro-4,4-dimethylpentane?
The InChIKey is MRHLZYMLHLVIMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10F6/c1-5(2,3)6(9,10)4(8)7(11,12)13/h4H,1-3H3.
What are the key properties of 1,1,1,2,3,3-hexafluoro-4,4-dimethylpentane?
1,1,1,2,3,3-hexafluoro-4,4-dimethylpentane has a molecular weight of 208.15 g/mol, XLogP of 3.57, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1,2,3,3-hexafluoro-4,4-dimethylpentane is sourced from PubChem (CID 10727045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).