2-[difluoro(methoxy)methyl]-1,1,3,3,3-pentafluoroprop-1-ene

C5H3F7O — CID 15829255

IUPAC2-[difluoro(methoxy)methyl]-1,1,3,3,3-pentafluoroprop-1-ene
SMILESCOC(F)(F)C(=C(F)F)C(F)(F)F
InChIInChI=1S/C5H3F7O/c1-13-5(11,12)2(3(6)7)4(8,9)10/h1H3
InChIKeyKJYWHFWNWWBARX-UHFFFAOYSA-N
MW212.06 g/mol
LogP2.94
Rot. Bonds2

About 2-[difluoro(methoxy)methyl]-1,1,3,3,3-pentafluoroprop-1-ene

2-[difluoro(methoxy)methyl]-1,1,3,3,3-pentafluoroprop-1-ene (PubChem CID 15829255) has the molecular formula C5H3F7O and a molecular weight of 212.06 g/mol. Its IUPAC name is 2-[difluoro(methoxy)methyl]-1,1,3,3,3-pentafluoroprop-1-ene.

Molecular Properties

Compound Name2-[difluoro(methoxy)methyl]-1,1,3,3,3-pentafluoroprop-1-ene
PubChem CID15829255
Molecular FormulaC5H3F7O
Molecular Weight212.06 g/mol
Exact Mass212.01
IUPAC Name2-[difluoro(methoxy)methyl]-1,1,3,3,3-pentafluoroprop-1-ene
SMILESCOC(F)(F)C(=C(F)F)C(F)(F)F
InChIInChI=1S/C5H3F7O/c1-13-5(11,12)2(3(6)7)4(8,9)10/h1H3
InChIKeyKJYWHFWNWWBARX-UHFFFAOYSA-N
XLogP2.94
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.06
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-[bromo(difluoro)methyl]-1,1,3,3,3-pentafluoroprop-1-ene
CID 564811
ethene;1,1,3,3,3-pentafluoro-2-(trifluoromethyl)prop-1-ene
CID 88622012
1,1,3,3-tetrafluoro-4-methyl-2-(trifluoromethyl)pent-1-ene
CID 23264394
1,1,3,4,4,5,6,6,6-nonafluoro-2,3,5-tris(trifluoromethyl)hex-1-ene
CID 87932326
2,2-difluoro-2-methoxyacetate
CID 164747737
1,1,1,3,4,4-hexafluoro-2-(trifluoromethyl)pent-2-ene
CID 130330536
(Z)-1,1,1,2,3,4,5,5,5-nonafluoro-4-methoxypent-2-ene
CID 146451149
(E)-1,2,3,3,3-pentafluoro-1-methoxyprop-1-ene
CID 10176261
2,3-difluoro-2,3-dimethoxybutane
CID 174333179
(E)-1,2-difluoroprop-1-ene;trifluoro(methoxy)methane
CID 165078646
4-(1,1,3,3,3-pentafluoroprop-1-en-2-yl)morpholine
CID 118673874
benzene;fluoromethane;methoxymethane;1,1,3,3,3-pentafluoro-2-methylprop-1-ene;tetrafluoromethane
CID 161070147

Frequently Asked Questions

What is the IUPAC name of 2-[difluoro(methoxy)methyl]-1,1,3,3,3-pentafluoroprop-1-ene?
The IUPAC name of 2-[difluoro(methoxy)methyl]-1,1,3,3,3-pentafluoroprop-1-ene (CID 15829255) is 2-[difluoro(methoxy)methyl]-1,1,3,3,3-pentafluoroprop-1-ene.
What is the SMILES notation for 2-[difluoro(methoxy)methyl]-1,1,3,3,3-pentafluoroprop-1-ene?
The canonical SMILES for 2-[difluoro(methoxy)methyl]-1,1,3,3,3-pentafluoroprop-1-ene is COC(F)(F)C(=C(F)F)C(F)(F)F.
What is the InChIKey of 2-[difluoro(methoxy)methyl]-1,1,3,3,3-pentafluoroprop-1-ene?
The InChIKey is KJYWHFWNWWBARX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3F7O/c1-13-5(11,12)2(3(6)7)4(8,9)10/h1H3.
What are the key properties of 2-[difluoro(methoxy)methyl]-1,1,3,3,3-pentafluoroprop-1-ene?
2-[difluoro(methoxy)methyl]-1,1,3,3,3-pentafluoroprop-1-ene has a molecular weight of 212.06 g/mol, XLogP of 2.94, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[difluoro(methoxy)methyl]-1,1,3,3,3-pentafluoroprop-1-ene is sourced from PubChem (CID 15829255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).