(1,1-difluoro-2-methylpropoxy)methylcyclopropane

C8H14F2O — CID 58422601

IUPAC(1,1-difluoro-2-methylpropoxy)methylcyclopropane
SMILESCC(C)C(F)(F)OCC1CC1
InChIInChI=1S/C8H14F2O/c1-6(2)8(9,10)11-5-7-3-4-7/h6-7H,3-5H2,1-2H3
InChIKeyMLCBFNZTGKRHSR-UHFFFAOYSA-N
MW164.19 g/mol
LogP2.66
Rot. Bonds4

About (1,1-difluoro-2-methylpropoxy)methylcyclopropane

(1,1-difluoro-2-methylpropoxy)methylcyclopropane (PubChem CID 58422601) has the molecular formula C8H14F2O and a molecular weight of 164.19 g/mol. Its IUPAC name is (1,1-difluoro-2-methylpropoxy)methylcyclopropane.

Molecular Properties

Compound Name(1,1-difluoro-2-methylpropoxy)methylcyclopropane
PubChem CID58422601
Molecular FormulaC8H14F2O
Molecular Weight164.19 g/mol
Exact Mass164.10
IUPAC Name(1,1-difluoro-2-methylpropoxy)methylcyclopropane
SMILESCC(C)C(F)(F)OCC1CC1
InChIInChI=1S/C8H14F2O/c1-6(2)8(9,10)11-5-7-3-4-7/h6-7H,3-5H2,1-2H3
InChIKeyMLCBFNZTGKRHSR-UHFFFAOYSA-N
XLogP2.66
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.19
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,2,3,3-Tetrafluoropropyloxy)-3-methylbutane
CID 129766049
4-Ethoxy-1,2,2-trifluoro-3-methylbutane
CID 15507745
2-Methyl-1-(2,2,3,3,3-pentafluoropropoxy)butane
CID 20793147
1-Ethoxy-1,1-difluoro-2-methylbutane
CID 20802235
2-Methyl-1-(4,4,4-trifluorobutoxy)butane
CID 21657863
2-Methyl-1-(3,3,3-trifluoropropoxy)butane
CID 21657872
3-Butoxy-1,1,1-trifluoro-2-methylpropane
CID 22002881
2-(Ethoxymethyl)-1,1,1-trifluorobutane
CID 22002892
2-(Butoxymethyl)-1,1,1-trifluorobutane
CID 22002934
2-(Difluoromethyl)-1,1,1,2,3,3-hexafluoro-3-(2-methylpropoxy)propane
CID 22137191
1,1-Difluoro-2-(methoxymethyl)cyclopropane
CID 53761669
[Ethoxy(difluoro)methyl]cyclopropane
CID 53923791

Frequently Asked Questions

What is the IUPAC name of (1,1-difluoro-2-methylpropoxy)methylcyclopropane?
The IUPAC name of (1,1-difluoro-2-methylpropoxy)methylcyclopropane (CID 58422601) is (1,1-difluoro-2-methylpropoxy)methylcyclopropane.
What is the SMILES notation for (1,1-difluoro-2-methylpropoxy)methylcyclopropane?
The canonical SMILES for (1,1-difluoro-2-methylpropoxy)methylcyclopropane is CC(C)C(F)(F)OCC1CC1.
What is the InChIKey of (1,1-difluoro-2-methylpropoxy)methylcyclopropane?
The InChIKey is MLCBFNZTGKRHSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F2O/c1-6(2)8(9,10)11-5-7-3-4-7/h6-7H,3-5H2,1-2H3.
What are the key properties of (1,1-difluoro-2-methylpropoxy)methylcyclopropane?
(1,1-difluoro-2-methylpropoxy)methylcyclopropane has a molecular weight of 164.19 g/mol, XLogP of 2.66, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1,1-difluoro-2-methylpropoxy)methylcyclopropane is sourced from PubChem (CID 58422601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).