1,1-difluoroethene;1,1,2,3,3,3-hexafluoroprop-1-ene;propan-2-one

C8H8F8O — CID 174716438

IUPAC1,1-difluoroethene;1,1,2,3,3,3-hexafluoroprop-1-ene;propan-2-one
SMILESC=C(F)F.CC(C)=O.FC(F)=C(F)C(F)(F)F
InChIInChI=1S/C3F6.C3H6O.C2H2F2/c4-1(2(5)6)3(7,8)9;1-3(2)4;1-2(3)4/h;1-2H3;1H2
InChIKeyBRCYPJRHRQFAEI-UHFFFAOYSA-N
MW272.14 g/mol
LogP4.62
Rot. Bonds

About 1,1-difluoroethene;1,1,2,3,3,3-hexafluoroprop-1-ene;propan-2-one

1,1-difluoroethene;1,1,2,3,3,3-hexafluoroprop-1-ene;propan-2-one (PubChem CID 174716438) has the molecular formula C8H8F8O and a molecular weight of 272.14 g/mol. Its IUPAC name is 1,1-difluoroethene;1,1,2,3,3,3-hexafluoroprop-1-ene;propan-2-one.

Molecular Properties

Compound Name1,1-difluoroethene;1,1,2,3,3,3-hexafluoroprop-1-ene;propan-2-one
PubChem CID174716438
Molecular FormulaC8H8F8O
Molecular Weight272.14 g/mol
Exact Mass272.04
IUPAC Name1,1-difluoroethene;1,1,2,3,3,3-hexafluoroprop-1-ene;propan-2-one
SMILESC=C(F)F.CC(C)=O.FC(F)=C(F)C(F)(F)F
InChIInChI=1S/C3F6.C3H6O.C2H2F2/c4-1(2(5)6)3(7,8)9;1-3(2)4;1-2(3)4/h;1-2H3;1H2
InChIKeyBRCYPJRHRQFAEI-UHFFFAOYSA-N
XLogP4.62
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.14
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,1-difluoroethene;1,1,2,3,3,3-hexafluoroprop-1-ene;propan-2-one?
The IUPAC name of 1,1-difluoroethene;1,1,2,3,3,3-hexafluoroprop-1-ene;propan-2-one (CID 174716438) is 1,1-difluoroethene;1,1,2,3,3,3-hexafluoroprop-1-ene;propan-2-one.
What is the SMILES notation for 1,1-difluoroethene;1,1,2,3,3,3-hexafluoroprop-1-ene;propan-2-one?
The canonical SMILES for 1,1-difluoroethene;1,1,2,3,3,3-hexafluoroprop-1-ene;propan-2-one is C=C(F)F.CC(C)=O.FC(F)=C(F)C(F)(F)F.
What is the InChIKey of 1,1-difluoroethene;1,1,2,3,3,3-hexafluoroprop-1-ene;propan-2-one?
The InChIKey is BRCYPJRHRQFAEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C3F6.C3H6O.C2H2F2/c4-1(2(5)6)3(7,8)9;1-3(2)4;1-2(3)4/h;1-2H3;1H2.
What are the key properties of 1,1-difluoroethene;1,1,2,3,3,3-hexafluoroprop-1-ene;propan-2-one?
1,1-difluoroethene;1,1,2,3,3,3-hexafluoroprop-1-ene;propan-2-one has a molecular weight of 272.14 g/mol, XLogP of 4.62, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-difluoroethene;1,1,2,3,3,3-hexafluoroprop-1-ene;propan-2-one is sourced from PubChem (CID 174716438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).