(2R)-1,1,1-trifluoro-2,3,3-trimethylbutane

C7H13F3 — CID 89330096

IUPAC(2R)-1,1,1-trifluoro-2,3,3-trimethylbutane
SMILESC[C@H](C(C)(C)C)C(F)(F)F
InChIInChI=1S/C7H13F3/c1-5(6(2,3)4)7(8,9)10/h5H,1-4H3/t5-/m1/s1
InChIKeyHAPFDFRZLLZMIH-RXMQYKEDSA-N
MW154.17 g/mol
LogP3.23
Rot. Bonds

About (2R)-1,1,1-trifluoro-2,3,3-trimethylbutane

(2R)-1,1,1-trifluoro-2,3,3-trimethylbutane (PubChem CID 89330096) has the molecular formula C7H13F3 and a molecular weight of 154.17 g/mol. Its IUPAC name is (2R)-1,1,1-trifluoro-2,3,3-trimethylbutane.

Molecular Properties

Compound Name(2R)-1,1,1-trifluoro-2,3,3-trimethylbutane
PubChem CID89330096
Molecular FormulaC7H13F3
Molecular Weight154.17 g/mol
Exact Mass154.10
IUPAC Name(2R)-1,1,1-trifluoro-2,3,3-trimethylbutane
SMILESC[C@H](C(C)(C)C)C(F)(F)F
InChIInChI=1S/C7H13F3/c1-5(6(2,3)4)7(8,9)10/h5H,1-4H3/t5-/m1/s1
InChIKeyHAPFDFRZLLZMIH-RXMQYKEDSA-N
XLogP3.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (2R)-1,1,1-trifluoro-2,3,3-trimethylbutane?
The IUPAC name of (2R)-1,1,1-trifluoro-2,3,3-trimethylbutane (CID 89330096) is (2R)-1,1,1-trifluoro-2,3,3-trimethylbutane.
What is the SMILES notation for (2R)-1,1,1-trifluoro-2,3,3-trimethylbutane?
The canonical SMILES for (2R)-1,1,1-trifluoro-2,3,3-trimethylbutane is C[C@H](C(C)(C)C)C(F)(F)F.
What is the InChIKey of (2R)-1,1,1-trifluoro-2,3,3-trimethylbutane?
The InChIKey is HAPFDFRZLLZMIH-RXMQYKEDSA-N. The full InChI is InChI=1S/C7H13F3/c1-5(6(2,3)4)7(8,9)10/h5H,1-4H3/t5-/m1/s1.
What are the key properties of (2R)-1,1,1-trifluoro-2,3,3-trimethylbutane?
(2R)-1,1,1-trifluoro-2,3,3-trimethylbutane has a molecular weight of 154.17 g/mol, XLogP of 3.23, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1,1,1-trifluoro-2,3,3-trimethylbutane is sourced from PubChem (CID 89330096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).