1-fluoro-1-(2,2,2-trifluoro-1-methoxyethyl)cyclopropane

C6H8F4O — CID 59850431

IUPAC1-fluoro-1-(2,2,2-trifluoro-1-methoxyethyl)cyclopropane
SMILESCOC(C(F)(F)F)C1(F)CC1
InChIInChI=1S/C6H8F4O/c1-11-4(6(8,9)10)5(7)2-3-5/h4H,2-3H2,1H3
InChIKeyJRYSLYNLDSCCHP-UHFFFAOYSA-N
MW172.12 g/mol
LogP2.07
Rot. Bonds2

About 1-fluoro-1-(2,2,2-trifluoro-1-methoxyethyl)cyclopropane

1-fluoro-1-(2,2,2-trifluoro-1-methoxyethyl)cyclopropane (PubChem CID 59850431) has the molecular formula C6H8F4O and a molecular weight of 172.12 g/mol. Its IUPAC name is 1-fluoro-1-(2,2,2-trifluoro-1-methoxyethyl)cyclopropane.

Molecular Properties

Compound Name1-fluoro-1-(2,2,2-trifluoro-1-methoxyethyl)cyclopropane
PubChem CID59850431
Molecular FormulaC6H8F4O
Molecular Weight172.12 g/mol
Exact Mass172.05
IUPAC Name1-fluoro-1-(2,2,2-trifluoro-1-methoxyethyl)cyclopropane
SMILESCOC(C(F)(F)F)C1(F)CC1
InChIInChI=1S/C6H8F4O/c1-11-4(6(8,9)10)5(7)2-3-5/h4H,2-3H2,1H3
InChIKeyJRYSLYNLDSCCHP-UHFFFAOYSA-N
XLogP2.07
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.12
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2,3,3,3-Tetrafluoro-2-methylpropyl)oxirane
CID 18702695
1,1,1,2-Tetrafluoro-3-methoxy-2-methylpentane
CID 58165689
CID 58450320
CID 58450320
1,1,1,4,4-Pentafluoro-2-(fluoromethoxy)pentane
CID 59837087
(2,2,2-Trifluoro-1-methoxyethyl)cyclopropane
CID 68215954
1,1,2,2,3-Pentafluoro-3-[1-[1-(1,2,2,3,3-pentafluorocyclopropyl)ethoxy]ethyl]cyclopropane
CID 87879724
1,1,1,4,4-Pentafluoro-2-methoxypentane
CID 88553109
1-Ethyl-2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)cyclopropane
CID 89832062
Fluoromethane;1,1,1-trifluoro-2-methoxypentane
CID 91097806
1,1,1-Trifluoro-2-methoxypentane;hydrofluoride
CID 91463480
1-(2,2,2-Trifluoroethoxy)ethylcyclopropane
CID 160019520
1,1,1,2,5,5,5-Heptafluoro-3-methoxy-2-methylpentane
CID 161379266

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-1-(2,2,2-trifluoro-1-methoxyethyl)cyclopropane?
The IUPAC name of 1-fluoro-1-(2,2,2-trifluoro-1-methoxyethyl)cyclopropane (CID 59850431) is 1-fluoro-1-(2,2,2-trifluoro-1-methoxyethyl)cyclopropane.
What is the SMILES notation for 1-fluoro-1-(2,2,2-trifluoro-1-methoxyethyl)cyclopropane?
The canonical SMILES for 1-fluoro-1-(2,2,2-trifluoro-1-methoxyethyl)cyclopropane is COC(C(F)(F)F)C1(F)CC1.
What is the InChIKey of 1-fluoro-1-(2,2,2-trifluoro-1-methoxyethyl)cyclopropane?
The InChIKey is JRYSLYNLDSCCHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8F4O/c1-11-4(6(8,9)10)5(7)2-3-5/h4H,2-3H2,1H3.
What are the key properties of 1-fluoro-1-(2,2,2-trifluoro-1-methoxyethyl)cyclopropane?
1-fluoro-1-(2,2,2-trifluoro-1-methoxyethyl)cyclopropane has a molecular weight of 172.12 g/mol, XLogP of 2.07, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-1-(2,2,2-trifluoro-1-methoxyethyl)cyclopropane is sourced from PubChem (CID 59850431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).