ethylsulfanylethane;trihydrofluoride

C4H13F3S — CID 172701158

IUPACethylsulfanylethane;trihydrofluoride
SMILESCCSCC.F.F.F
InChIInChI=1S/C4H10S.3FH/c1-3-5-4-2;;;/h3-4H2,1-2H3;3*1H
InChIKeyCZGFGVCPCLUESS-UHFFFAOYSA-N
MW150.21 g/mol
LogP2.22
Rot. Bonds2

About ethylsulfanylethane;trihydrofluoride

ethylsulfanylethane;trihydrofluoride (PubChem CID 172701158) has the molecular formula C4H13F3S and a molecular weight of 150.21 g/mol. Its IUPAC name is ethylsulfanylethane;trihydrofluoride.

Molecular Properties

Compound Nameethylsulfanylethane;trihydrofluoride
PubChem CID172701158
Molecular FormulaC4H13F3S
Molecular Weight150.21 g/mol
Exact Mass150.07
IUPAC Nameethylsulfanylethane;trihydrofluoride
SMILESCCSCC.F.F.F
InChIInChI=1S/C4H10S.3FH/c1-3-5-4-2;;;/h3-4H2,1-2H3;3*1H
InChIKeyCZGFGVCPCLUESS-UHFFFAOYSA-N
XLogP2.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.21
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of ethylsulfanylethane;trihydrofluoride?
The IUPAC name of ethylsulfanylethane;trihydrofluoride (CID 172701158) is ethylsulfanylethane;trihydrofluoride.
What is the SMILES notation for ethylsulfanylethane;trihydrofluoride?
The canonical SMILES for ethylsulfanylethane;trihydrofluoride is CCSCC.F.F.F.
What is the InChIKey of ethylsulfanylethane;trihydrofluoride?
The InChIKey is CZGFGVCPCLUESS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10S.3FH/c1-3-5-4-2;;;/h3-4H2,1-2H3;3*1H.
What are the key properties of ethylsulfanylethane;trihydrofluoride?
ethylsulfanylethane;trihydrofluoride has a molecular weight of 150.21 g/mol, XLogP of 2.22, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethylsulfanylethane;trihydrofluoride is sourced from PubChem (CID 172701158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).