1,1,1,2,3-pentafluoropropan-2-yl hypofluorite

C3H2F6O — CID 19366123

IUPAC1,1,1,2,3-pentafluoropropan-2-yl hypofluorite
SMILESFCC(F)(OF)C(F)(F)F
InChIInChI=1S/C3H2F6O/c4-1-2(5,10-9)3(6,7)8/h1H2
InChIKeyRUWSTELIPNTULS-UHFFFAOYSA-N
MW168.04 g/mol
LogP2.09
Rot. Bonds2

About 1,1,1,2,3-pentafluoropropan-2-yl hypofluorite

1,1,1,2,3-pentafluoropropan-2-yl hypofluorite (PubChem CID 19366123) has the molecular formula C3H2F6O and a molecular weight of 168.04 g/mol. Its IUPAC name is 1,1,1,2,3-pentafluoropropan-2-yl hypofluorite.

Molecular Properties

Compound Name1,1,1,2,3-pentafluoropropan-2-yl hypofluorite
PubChem CID19366123
Molecular FormulaC3H2F6O
Molecular Weight168.04 g/mol
Exact Mass168.00
IUPAC Name1,1,1,2,3-pentafluoropropan-2-yl hypofluorite
SMILESFCC(F)(OF)C(F)(F)F
InChIInChI=1S/C3H2F6O/c4-1-2(5,10-9)3(6,7)8/h1H2
InChIKeyRUWSTELIPNTULS-UHFFFAOYSA-N
XLogP2.09
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.04
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,1,1,2,3,3-Hexafluoro-2-propanol
CID 13350568
Pentafluoro isopropanol
CID 21645339
1,2,2,2-Tetrafluoro-1-(trifluoromethyl)ethyl hypofluorite
CID 10130432
1,1,2,3,3,3-Hexafluoropropyl hypoiodite
CID 17859952
1,1,2,3,3,3-Hexafluoropropyl hypobromite
CID 17859953
1,1,2,3,3,3-Hexafluoropropyl hypochlorite
CID 17859956
1,1,2,2,3-Pentafluoropropyl hypofluorite
CID 22084400
1,1,2-Trifluoroethyl hypofluorite
CID 22084402
1,1,3,3,3-Pentafluoropropyl hypofluorite
CID 22094285
(1,2,2,3-Tetrafluorocyclopropyl) hypofluorite
CID 22495106
(1,2,2-Trifluorocyclopropyl) hypofluorite
CID 22495107
1,1,2,2-Tetrafluoroethyl hypofluorite
CID 23233306

Frequently Asked Questions

What is the IUPAC name of 1,1,1,2,3-pentafluoropropan-2-yl hypofluorite?
The IUPAC name of 1,1,1,2,3-pentafluoropropan-2-yl hypofluorite (CID 19366123) is 1,1,1,2,3-pentafluoropropan-2-yl hypofluorite.
What is the SMILES notation for 1,1,1,2,3-pentafluoropropan-2-yl hypofluorite?
The canonical SMILES for 1,1,1,2,3-pentafluoropropan-2-yl hypofluorite is FCC(F)(OF)C(F)(F)F.
What is the InChIKey of 1,1,1,2,3-pentafluoropropan-2-yl hypofluorite?
The InChIKey is RUWSTELIPNTULS-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H2F6O/c4-1-2(5,10-9)3(6,7)8/h1H2.
What are the key properties of 1,1,1,2,3-pentafluoropropan-2-yl hypofluorite?
1,1,1,2,3-pentafluoropropan-2-yl hypofluorite has a molecular weight of 168.04 g/mol, XLogP of 2.09, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1,2,3-pentafluoropropan-2-yl hypofluorite is sourced from PubChem (CID 19366123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).