1,2,2,2-tetrafluoroethanol

C2H2F4O — CID 19350069

IUPAC1,2,2,2-tetrafluoroethanol
SMILESOC(F)C(F)(F)F
InChIInChI=1S/C2H2F4O/c3-1(7)2(4,5)6/h1,7H
InChIKeyYXQBLRACMQTNQR-UHFFFAOYSA-N
MW118.03 g/mol
LogP0.84
Rot. Bonds

About 1,2,2,2-tetrafluoroethanol

1,2,2,2-tetrafluoroethanol (PubChem CID 19350069) has the molecular formula C2H2F4O and a molecular weight of 118.03 g/mol. Its IUPAC name is 1,2,2,2-tetrafluoroethanol.

Molecular Properties

Compound Name1,2,2,2-tetrafluoroethanol
PubChem CID19350069
Molecular FormulaC2H2F4O
Molecular Weight118.03 g/mol
Exact Mass118.00
IUPAC Name1,2,2,2-tetrafluoroethanol
SMILESOC(F)C(F)(F)F
InChIInChI=1S/C2H2F4O/c3-1(7)2(4,5)6/h1,7H
InChIKeyYXQBLRACMQTNQR-UHFFFAOYSA-N
XLogP0.84
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.03
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,2,2,2-tetrafluoroethanol?
The IUPAC name of 1,2,2,2-tetrafluoroethanol (CID 19350069) is 1,2,2,2-tetrafluoroethanol.
What is the SMILES notation for 1,2,2,2-tetrafluoroethanol?
The canonical SMILES for 1,2,2,2-tetrafluoroethanol is OC(F)C(F)(F)F.
What is the InChIKey of 1,2,2,2-tetrafluoroethanol?
The InChIKey is YXQBLRACMQTNQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H2F4O/c3-1(7)2(4,5)6/h1,7H.
What are the key properties of 1,2,2,2-tetrafluoroethanol?
1,2,2,2-tetrafluoroethanol has a molecular weight of 118.03 g/mol, XLogP of 0.84, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,2,2-tetrafluoroethanol is sourced from PubChem (CID 19350069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).