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

C6H10F2O — CID 155380331

IUPAC1,1-difluoro-2-(methoxymethyl)-2-methylcyclopropane
SMILESCOCC1(C)CC1(F)F
InChIInChI=1S/C6H10F2O/c1-5(4-9-2)3-6(5,7)8/h3-4H2,1-2H3
InChIKeyPCXSHHMPZXMIGM-UHFFFAOYSA-N
MW136.14 g/mol
LogP1.68
Rot. Bonds2

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

1,1-difluoro-2-(methoxymethyl)-2-methylcyclopropane (PubChem CID 155380331) has the molecular formula C6H10F2O and a molecular weight of 136.14 g/mol. Its IUPAC name is 1,1-difluoro-2-(methoxymethyl)-2-methylcyclopropane.

Molecular Properties

Compound Name1,1-difluoro-2-(methoxymethyl)-2-methylcyclopropane
PubChem CID155380331
Molecular FormulaC6H10F2O
Molecular Weight136.14 g/mol
Exact Mass136.07
IUPAC Name1,1-difluoro-2-(methoxymethyl)-2-methylcyclopropane
SMILESCOCC1(C)CC1(F)F
InChIInChI=1S/C6H10F2O/c1-5(4-9-2)3-6(5,7)8/h3-4H2,1-2H3
InChIKeyPCXSHHMPZXMIGM-UHFFFAOYSA-N
XLogP1.68
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.14
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,1-difluoro-2-(methoxymethyl)-2-methylcyclopropane?
The IUPAC name of 1,1-difluoro-2-(methoxymethyl)-2-methylcyclopropane (CID 155380331) is 1,1-difluoro-2-(methoxymethyl)-2-methylcyclopropane.
What is the SMILES notation for 1,1-difluoro-2-(methoxymethyl)-2-methylcyclopropane?
The canonical SMILES for 1,1-difluoro-2-(methoxymethyl)-2-methylcyclopropane is COCC1(C)CC1(F)F.
What is the InChIKey of 1,1-difluoro-2-(methoxymethyl)-2-methylcyclopropane?
The InChIKey is PCXSHHMPZXMIGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F2O/c1-5(4-9-2)3-6(5,7)8/h3-4H2,1-2H3.
What are the key properties of 1,1-difluoro-2-(methoxymethyl)-2-methylcyclopropane?
1,1-difluoro-2-(methoxymethyl)-2-methylcyclopropane has a molecular weight of 136.14 g/mol, XLogP of 1.68, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-difluoro-2-(methoxymethyl)-2-methylcyclopropane is sourced from PubChem (CID 155380331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).