2-methyl-2-[(2R)-1,1,1-trifluoro-3-propan-2-yloxypropan-2-yl]oxypropane

C10H19F3O2 — CID 59223649

IUPAC2-methyl-2-[(2R)-1,1,1-trifluoro-3-propan-2-yloxypropan-2-yl]oxypropane
SMILESCC(C)OC[C@@H](OC(C)(C)C)C(F)(F)F
InChIInChI=1S/C10H19F3O2/c1-7(2)14-6-8(10(11,12)13)15-9(3,4)5/h7-8H,6H2,1-5H3/t8-/m1/s1
InChIKeyLTBCVLATGAZYFO-MRVPVSSYSA-N
MW228.25 g/mol
LogP3.16
Rot. Bonds4

About 2-methyl-2-[(2R)-1,1,1-trifluoro-3-propan-2-yloxypropan-2-yl]oxypropane

2-methyl-2-[(2R)-1,1,1-trifluoro-3-propan-2-yloxypropan-2-yl]oxypropane (PubChem CID 59223649) has the molecular formula C10H19F3O2 and a molecular weight of 228.25 g/mol. Its IUPAC name is 2-methyl-2-[(2R)-1,1,1-trifluoro-3-propan-2-yloxypropan-2-yl]oxypropane.

Molecular Properties

Compound Name2-methyl-2-[(2R)-1,1,1-trifluoro-3-propan-2-yloxypropan-2-yl]oxypropane
PubChem CID59223649
Molecular FormulaC10H19F3O2
Molecular Weight228.25 g/mol
Exact Mass228.13
IUPAC Name2-methyl-2-[(2R)-1,1,1-trifluoro-3-propan-2-yloxypropan-2-yl]oxypropane
SMILESCC(C)OC[C@@H](OC(C)(C)C)C(F)(F)F
InChIInChI=1S/C10H19F3O2/c1-7(2)14-6-8(10(11,12)13)15-9(3,4)5/h7-8H,6H2,1-5H3/t8-/m1/s1
InChIKeyLTBCVLATGAZYFO-MRVPVSSYSA-N
XLogP3.16
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[(2R)-1,1,1-trifluoro-3-propan-2-yloxypropan-2-yl]oxypropane?
The IUPAC name of 2-methyl-2-[(2R)-1,1,1-trifluoro-3-propan-2-yloxypropan-2-yl]oxypropane (CID 59223649) is 2-methyl-2-[(2R)-1,1,1-trifluoro-3-propan-2-yloxypropan-2-yl]oxypropane.
What is the SMILES notation for 2-methyl-2-[(2R)-1,1,1-trifluoro-3-propan-2-yloxypropan-2-yl]oxypropane?
The canonical SMILES for 2-methyl-2-[(2R)-1,1,1-trifluoro-3-propan-2-yloxypropan-2-yl]oxypropane is CC(C)OC[C@@H](OC(C)(C)C)C(F)(F)F.
What is the InChIKey of 2-methyl-2-[(2R)-1,1,1-trifluoro-3-propan-2-yloxypropan-2-yl]oxypropane?
The InChIKey is LTBCVLATGAZYFO-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H19F3O2/c1-7(2)14-6-8(10(11,12)13)15-9(3,4)5/h7-8H,6H2,1-5H3/t8-/m1/s1.
What are the key properties of 2-methyl-2-[(2R)-1,1,1-trifluoro-3-propan-2-yloxypropan-2-yl]oxypropane?
2-methyl-2-[(2R)-1,1,1-trifluoro-3-propan-2-yloxypropan-2-yl]oxypropane has a molecular weight of 228.25 g/mol, XLogP of 3.16, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[(2R)-1,1,1-trifluoro-3-propan-2-yloxypropan-2-yl]oxypropane is sourced from PubChem (CID 59223649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).