1,1-bis(ethylsulfanyl)-2,3,3,3-tetrafluoroprop-1-ene

C7H10F4S2 — CID 10399121

IUPAC1,1-bis(ethylsulfanyl)-2,3,3,3-tetrafluoroprop-1-ene
SMILESCCSC(SCC)=C(F)C(F)(F)F
InChIInChI=1S/C7H10F4S2/c1-3-12-6(13-4-2)5(8)7(9,10)11/h3-4H2,1-2H3
InChIKeyYXFDAWYXJUJONO-UHFFFAOYSA-N
MW234.28 g/mol
LogP4.19
Rot. Bonds4

About 1,1-bis(ethylsulfanyl)-2,3,3,3-tetrafluoroprop-1-ene

1,1-bis(ethylsulfanyl)-2,3,3,3-tetrafluoroprop-1-ene (PubChem CID 10399121) has the molecular formula C7H10F4S2 and a molecular weight of 234.28 g/mol. Its IUPAC name is 1,1-bis(ethylsulfanyl)-2,3,3,3-tetrafluoroprop-1-ene.

Molecular Properties

Compound Name1,1-bis(ethylsulfanyl)-2,3,3,3-tetrafluoroprop-1-ene
PubChem CID10399121
Molecular FormulaC7H10F4S2
Molecular Weight234.28 g/mol
Exact Mass234.02
IUPAC Name1,1-bis(ethylsulfanyl)-2,3,3,3-tetrafluoroprop-1-ene
SMILESCCSC(SCC)=C(F)C(F)(F)F
InChIInChI=1S/C7H10F4S2/c1-3-12-6(13-4-2)5(8)7(9,10)11/h3-4H2,1-2H3
InChIKeyYXFDAWYXJUJONO-UHFFFAOYSA-N
XLogP4.19
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.28
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3,3-Bis-ethylsulfanyl-1,1,1,2,2-pentafluoro-propane
CID 10400060
1-Butene, 1,1-bis(ethylthio)-2,3,3,4,4,4-hexafluoro-
CID 10379130
2,2-Diethylthiohexafluoropropane
CID 12567447
1,1-Bis(ethylsulfanyl)-2,2-difluoroethene
CID 13508445
(E)-1-ethylsulfanyl-2,3,3,4,4,4-hexafluoro-1-propylsulfanylbut-1-ene
CID 134919681
(Z)-1-ethylsulfanyl-2,3,3,4,4,4-hexafluoro-1-propylsulfanylbut-1-ene
CID 15324458
1,1-Bis(ethylsulfanyl)-2,3,3,4,4,5,5-heptafluoropent-1-ene
CID 21579694
1,1-Bis[(trifluoromethyl)sulfanyl]butane
CID 71418138
(E)-2-ethylsulfanyl-3,3,3-trifluoro-1-methylsulfanylprop-1-ene
CID 100998495
3,3-Bis(ethylsulfanyl)-1,1-difluoroprop-1-ene
CID 101166122
1,1-Bis(ethylsulfanyl)-4,4,4-trifluoro-3-(trifluoromethyl)buta-1,2-diene
CID 102189621
1,1-Bis(ethylsulfanyl)-3,3-difluoropropa-1,2-diene
CID 102189624

Frequently Asked Questions

What is the IUPAC name of 1,1-bis(ethylsulfanyl)-2,3,3,3-tetrafluoroprop-1-ene?
The IUPAC name of 1,1-bis(ethylsulfanyl)-2,3,3,3-tetrafluoroprop-1-ene (CID 10399121) is 1,1-bis(ethylsulfanyl)-2,3,3,3-tetrafluoroprop-1-ene.
What is the SMILES notation for 1,1-bis(ethylsulfanyl)-2,3,3,3-tetrafluoroprop-1-ene?
The canonical SMILES for 1,1-bis(ethylsulfanyl)-2,3,3,3-tetrafluoroprop-1-ene is CCSC(SCC)=C(F)C(F)(F)F.
What is the InChIKey of 1,1-bis(ethylsulfanyl)-2,3,3,3-tetrafluoroprop-1-ene?
The InChIKey is YXFDAWYXJUJONO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10F4S2/c1-3-12-6(13-4-2)5(8)7(9,10)11/h3-4H2,1-2H3.
What are the key properties of 1,1-bis(ethylsulfanyl)-2,3,3,3-tetrafluoroprop-1-ene?
1,1-bis(ethylsulfanyl)-2,3,3,3-tetrafluoroprop-1-ene has a molecular weight of 234.28 g/mol, XLogP of 4.19, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-bis(ethylsulfanyl)-2,3,3,3-tetrafluoroprop-1-ene is sourced from PubChem (CID 10399121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).