2-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoro-4-methyl-3-propan-2-ylpentane

C11H15F9O — CID 19761966

IUPAC2-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoro-4-methyl-3-propan-2-ylpentane
SMILESCCOC(F)(C(F)(F)F)C(F)(C(C)C)C(C)(F)C(F)(F)F
InChIInChI=1S/C11H15F9O/c1-5-21-9(14,11(18,19)20)8(13,6(2)3)7(4,12)10(15,16)17/h6H,5H2,1-4H3
InChIKeyATIKFTIRFTUFSQ-UHFFFAOYSA-N
MW334.22 g/mol
LogP4.91
Rot. Bonds5

About 2-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoro-4-methyl-3-propan-2-ylpentane

2-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoro-4-methyl-3-propan-2-ylpentane (PubChem CID 19761966) has the molecular formula C11H15F9O and a molecular weight of 334.22 g/mol. Its IUPAC name is 2-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoro-4-methyl-3-propan-2-ylpentane.

Molecular Properties

Compound Name2-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoro-4-methyl-3-propan-2-ylpentane
PubChem CID19761966
Molecular FormulaC11H15F9O
Molecular Weight334.22 g/mol
Exact Mass334.10
IUPAC Name2-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoro-4-methyl-3-propan-2-ylpentane
SMILESCCOC(F)(C(F)(F)F)C(F)(C(C)C)C(C)(F)C(F)(F)F
InChIInChI=1S/C11H15F9O/c1-5-21-9(14,11(18,19)20)8(13,6(2)3)7(4,12)10(15,16)17/h6H,5H2,1-4H3
InChIKeyATIKFTIRFTUFSQ-UHFFFAOYSA-N
XLogP4.91
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.22
LogP ≤ 54.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoro-4-methyl-3-propan-2-ylpentane with MolForge

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Related Compounds

Hexafluorisopropylmethylather
CID 129635123
1-Fluoro-2-methyl-2-(2,2,2-trifluoroethoxy)pentane
CID 10584237
2-Butoxy-1,1,1,3,3,4,4,5,5,5-decafluoro-2-(trifluoromethyl)pentane
CID 12713814
2-Fluoro-3-propan-2-yl-3-(1,1,1,2-tetrafluoropropan-2-yl)-2-(trifluoromethyl)oxirane
CID 19067257
1,1,1,2,2,3,4,5,6,6,6-Undecafluoro-5-methoxy-3-methyl-4-propan-2-ylhexane
CID 19761923
2-Ethoxy-1,1,1,2,3,4,5,5,6,6,6-undecafluoro-4-methyl-3-propan-2-ylhexane
CID 19761925
1,1,1,2,2,3,3,5,5,5-Decafluoro-4-methyl-4-(2-methylpropoxy)pentane
CID 19761932
1,1,1,2,3,4,5,5,5-Nonafluoro-2,4-dimethyl-3-(2-methylpropoxy)pentane
CID 19761939
1,1,1,2,2,3,3,5,5,5-Decafluoro-4-methyl-4-(3-methylbutoxy)pentane
CID 19761941
1,1,1,2,2,3,4,5,5,5-Decafluoro-4-methyl-3-(2-methylpropoxy)pentane
CID 19761952
3-Ethoxy-1,1,1,2,3,4,5,5,5-nonafluoro-2,4-dimethylpentane
CID 19761961
1,1,1,2,2,3,3,5,5,5-Decafluoro-4-(3-methylbutoxy)-4-(trifluoromethyl)pentane
CID 19761962

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoro-4-methyl-3-propan-2-ylpentane?
The IUPAC name of 2-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoro-4-methyl-3-propan-2-ylpentane (CID 19761966) is 2-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoro-4-methyl-3-propan-2-ylpentane.
What is the SMILES notation for 2-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoro-4-methyl-3-propan-2-ylpentane?
The canonical SMILES for 2-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoro-4-methyl-3-propan-2-ylpentane is CCOC(F)(C(F)(F)F)C(F)(C(C)C)C(C)(F)C(F)(F)F.
What is the InChIKey of 2-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoro-4-methyl-3-propan-2-ylpentane?
The InChIKey is ATIKFTIRFTUFSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F9O/c1-5-21-9(14,11(18,19)20)8(13,6(2)3)7(4,12)10(15,16)17/h6H,5H2,1-4H3.
What are the key properties of 2-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoro-4-methyl-3-propan-2-ylpentane?
2-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoro-4-methyl-3-propan-2-ylpentane has a molecular weight of 334.22 g/mol, XLogP of 4.91, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoro-4-methyl-3-propan-2-ylpentane is sourced from PubChem (CID 19761966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).