[2-ethenyl-2-fluoro-1-(trifluoromethyl)cyclopropyl]methanol

C7H8F4O — CID 143369263

IUPAC[2-ethenyl-2-fluoro-1-(trifluoromethyl)cyclopropyl]methanol
SMILESC=CC1(F)CC1(CO)C(F)(F)F
InChIInChI=1S/C7H8F4O/c1-2-6(8)3-5(6,4-12)7(9,10)11/h2,12H,1,3-4H2
InChIKeyOZSKIYREBIUQOK-UHFFFAOYSA-N
MW184.13 g/mol
LogP1.83
Rot. Bonds2

About [2-ethenyl-2-fluoro-1-(trifluoromethyl)cyclopropyl]methanol

[2-ethenyl-2-fluoro-1-(trifluoromethyl)cyclopropyl]methanol (PubChem CID 143369263) has the molecular formula C7H8F4O and a molecular weight of 184.13 g/mol. Its IUPAC name is [2-ethenyl-2-fluoro-1-(trifluoromethyl)cyclopropyl]methanol.

Molecular Properties

Compound Name[2-ethenyl-2-fluoro-1-(trifluoromethyl)cyclopropyl]methanol
PubChem CID143369263
Molecular FormulaC7H8F4O
Molecular Weight184.13 g/mol
Exact Mass184.05
IUPAC Name[2-ethenyl-2-fluoro-1-(trifluoromethyl)cyclopropyl]methanol
SMILESC=CC1(F)CC1(CO)C(F)(F)F
InChIInChI=1S/C7H8F4O/c1-2-6(8)3-5(6,4-12)7(9,10)11/h2,12H,1,3-4H2
InChIKeyOZSKIYREBIUQOK-UHFFFAOYSA-N
XLogP1.83
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.13
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [2-ethenyl-2-fluoro-1-(trifluoromethyl)cyclopropyl]methanol?
The IUPAC name of [2-ethenyl-2-fluoro-1-(trifluoromethyl)cyclopropyl]methanol (CID 143369263) is [2-ethenyl-2-fluoro-1-(trifluoromethyl)cyclopropyl]methanol.
What is the SMILES notation for [2-ethenyl-2-fluoro-1-(trifluoromethyl)cyclopropyl]methanol?
The canonical SMILES for [2-ethenyl-2-fluoro-1-(trifluoromethyl)cyclopropyl]methanol is C=CC1(F)CC1(CO)C(F)(F)F.
What is the InChIKey of [2-ethenyl-2-fluoro-1-(trifluoromethyl)cyclopropyl]methanol?
The InChIKey is OZSKIYREBIUQOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F4O/c1-2-6(8)3-5(6,4-12)7(9,10)11/h2,12H,1,3-4H2.
What are the key properties of [2-ethenyl-2-fluoro-1-(trifluoromethyl)cyclopropyl]methanol?
[2-ethenyl-2-fluoro-1-(trifluoromethyl)cyclopropyl]methanol has a molecular weight of 184.13 g/mol, XLogP of 1.83, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-ethenyl-2-fluoro-1-(trifluoromethyl)cyclopropyl]methanol is sourced from PubChem (CID 143369263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).