fluoroform;sulfane;toluene

C8H11F3S — CID 171925089

IUPACfluoroform;sulfane;toluene
SMILESCc1ccccc1.FC(F)F.S
InChIInChI=1S/C7H8.CHF3.H2S/c1-7-5-3-2-4-6-7;2-1(3)4;/h2-6H,1H3;1H;1H2
InChIKeyASJHZENNHOVPJN-UHFFFAOYSA-N
MW196.24 g/mol
LogP3.29
Rot. Bonds

About fluoroform;sulfane;toluene

fluoroform;sulfane;toluene (PubChem CID 171925089) has the molecular formula C8H11F3S and a molecular weight of 196.24 g/mol. Its IUPAC name is fluoroform;sulfane;toluene.

Molecular Properties

Compound Namefluoroform;sulfane;toluene
PubChem CID171925089
Molecular FormulaC8H11F3S
Molecular Weight196.24 g/mol
Exact Mass196.05
IUPAC Namefluoroform;sulfane;toluene
SMILESCc1ccccc1.FC(F)F.S
InChIInChI=1S/C7H8.CHF3.H2S/c1-7-5-3-2-4-6-7;2-1(3)4;/h2-6H,1H3;1H;1H2
InChIKeyASJHZENNHOVPJN-UHFFFAOYSA-N
XLogP3.29
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.24
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of fluoroform;sulfane;toluene?
The IUPAC name of fluoroform;sulfane;toluene (CID 171925089) is fluoroform;sulfane;toluene.
What is the SMILES notation for fluoroform;sulfane;toluene?
The canonical SMILES for fluoroform;sulfane;toluene is Cc1ccccc1.FC(F)F.S.
What is the InChIKey of fluoroform;sulfane;toluene?
The InChIKey is ASJHZENNHOVPJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8.CHF3.H2S/c1-7-5-3-2-4-6-7;2-1(3)4;/h2-6H,1H3;1H;1H2.
What are the key properties of fluoroform;sulfane;toluene?
fluoroform;sulfane;toluene has a molecular weight of 196.24 g/mol, XLogP of 3.29, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for fluoroform;sulfane;toluene is sourced from PubChem (CID 171925089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).