2-(1,1-difluoro-2-prop-2-enoxyethoxy)-2,2-difluoroethanol

C7H10F4O3 — CID 153446275

IUPAC2-(1,1-difluoro-2-prop-2-enoxyethoxy)-2,2-difluoroethanol
SMILESC=CCOCC(F)(F)OC(F)(F)CO
InChIInChI=1S/C7H10F4O3/c1-2-3-13-5-7(10,11)14-6(8,9)4-12/h2,12H,1,3-5H2
InChIKeyBSIOFCWGSJLSOE-UHFFFAOYSA-N
MW218.15 g/mol
LogP1.38
Rot. Bonds7

About 2-(1,1-difluoro-2-prop-2-enoxyethoxy)-2,2-difluoroethanol

2-(1,1-difluoro-2-prop-2-enoxyethoxy)-2,2-difluoroethanol (PubChem CID 153446275) has the molecular formula C7H10F4O3 and a molecular weight of 218.15 g/mol. Its IUPAC name is 2-(1,1-difluoro-2-prop-2-enoxyethoxy)-2,2-difluoroethanol.

Molecular Properties

Compound Name2-(1,1-difluoro-2-prop-2-enoxyethoxy)-2,2-difluoroethanol
PubChem CID153446275
Molecular FormulaC7H10F4O3
Molecular Weight218.15 g/mol
Exact Mass218.06
IUPAC Name2-(1,1-difluoro-2-prop-2-enoxyethoxy)-2,2-difluoroethanol
SMILESC=CCOCC(F)(F)OC(F)(F)CO
InChIInChI=1S/C7H10F4O3/c1-2-3-13-5-7(10,11)14-6(8,9)4-12/h2,12H,1,3-5H2
InChIKeyBSIOFCWGSJLSOE-UHFFFAOYSA-N
XLogP1.38
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.15
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

Ethylene glycol monoallyl ether
CID 8116
2-(2-(Allyloxy)ethoxy)ethanol
CID 84777
3,3,3-Trifluoro-2-prop-2-enoxypropan-1-ol
CID 15215719
1-Fluoro-3-prop-2-enoxypropan-2-ol
CID 15053840
3,3-Difluoro-2-prop-2-enoxyprop-2-en-1-ol
CID 15215720
1,1,2,3,3,3-Hexafluoro-2-prop-2-enoxypropan-1-ol
CID 20186793
1,1,1-Trifluoro-3-prop-2-enoxypropan-2-ol
CID 22913249
3-(1,1,2,2-Tetrafluoro-2-methoxyethoxy)prop-1-ene
CID 54110883
1,1,1,2,2,3,3-Heptafluoro-3-(2-prop-2-enoxyethoxy)propane
CID 58057352
3,3,3-Trifluoro-2-(3,3,3-trifluoro-2-prop-2-enoxypropoxy)propan-1-ol
CID 87642564
2-[3,3,3-Trifluoro-2-prop-2-enoxy-2-(trifluoromethyl)propoxy]ethanol
CID 88009979
3-[1,1,2,2-Tetrafluoro-2-(trifluoromethoxy)ethoxy]prop-1-ene
CID 118138220

Frequently Asked Questions

What is the IUPAC name of 2-(1,1-difluoro-2-prop-2-enoxyethoxy)-2,2-difluoroethanol?
The IUPAC name of 2-(1,1-difluoro-2-prop-2-enoxyethoxy)-2,2-difluoroethanol (CID 153446275) is 2-(1,1-difluoro-2-prop-2-enoxyethoxy)-2,2-difluoroethanol.
What is the SMILES notation for 2-(1,1-difluoro-2-prop-2-enoxyethoxy)-2,2-difluoroethanol?
The canonical SMILES for 2-(1,1-difluoro-2-prop-2-enoxyethoxy)-2,2-difluoroethanol is C=CCOCC(F)(F)OC(F)(F)CO.
What is the InChIKey of 2-(1,1-difluoro-2-prop-2-enoxyethoxy)-2,2-difluoroethanol?
The InChIKey is BSIOFCWGSJLSOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10F4O3/c1-2-3-13-5-7(10,11)14-6(8,9)4-12/h2,12H,1,3-5H2.
What are the key properties of 2-(1,1-difluoro-2-prop-2-enoxyethoxy)-2,2-difluoroethanol?
2-(1,1-difluoro-2-prop-2-enoxyethoxy)-2,2-difluoroethanol has a molecular weight of 218.15 g/mol, XLogP of 1.38, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,1-difluoro-2-prop-2-enoxyethoxy)-2,2-difluoroethanol is sourced from PubChem (CID 153446275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).