phosphane;trifluoromethylbenzene

C7H8F3P — CID 175486194

IUPACphosphane;trifluoromethylbenzene
SMILESFC(F)(F)c1ccccc1.P
InChIInChI=1S/C7H5F3.H3P/c8-7(9,10)6-4-2-1-3-5-6;/h1-5H;1H3
InChIKeyHBPGLTVTYAJREM-UHFFFAOYSA-N
MW180.11 g/mol
LogP2.76
Rot. Bonds

About phosphane;trifluoromethylbenzene

phosphane;trifluoromethylbenzene (PubChem CID 175486194) has the molecular formula C7H8F3P and a molecular weight of 180.11 g/mol. Its IUPAC name is phosphane;trifluoromethylbenzene.

Molecular Properties

Compound Namephosphane;trifluoromethylbenzene
PubChem CID175486194
Molecular FormulaC7H8F3P
Molecular Weight180.11 g/mol
Exact Mass180.03
IUPAC Namephosphane;trifluoromethylbenzene
SMILESFC(F)(F)c1ccccc1.P
InChIInChI=1S/C7H5F3.H3P/c8-7(9,10)6-4-2-1-3-5-6;/h1-5H;1H3
InChIKeyHBPGLTVTYAJREM-UHFFFAOYSA-N
XLogP2.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.11
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

trifluoromethylbenzene;dihydrochloride
CID 171928889
ethane;bis(trifluoromethylbenzene)
CID 142912000
1-[bromo(diphenyl)methyl]-4-(trifluoromethyl)benzene
CID 154308793
chlorobenzene;trifluoromethylbenzene
CID 159341337
ethane;toluene;trifluoromethylbenzene
CID 161105309
phenylsulfanylbenzene;trifluoromethylbenzene
CID 171924180
diphenyl-[4-(trifluoromethyl)phenyl]methanol
CID 569997
hydrazine;sulfuric acid;trifluoromethylbenzene
CID 174887305
azidomethane;trifluoromethylbenzene
CID 175515573
1-methyl-4-(trifluoromethyl)benzene;toluene
CID 159876070
1-iodo-4-propan-2-ylbenzene;trifluoromethylbenzene
CID 174465530
2,2,3,3,3-pentafluoro-1-phenyl-1-[4-(trifluoromethyl)phenyl]propan-1-ol
CID 162511318

Frequently Asked Questions

What is the IUPAC name of phosphane;trifluoromethylbenzene?
The IUPAC name of phosphane;trifluoromethylbenzene (CID 175486194) is phosphane;trifluoromethylbenzene.
What is the SMILES notation for phosphane;trifluoromethylbenzene?
The canonical SMILES for phosphane;trifluoromethylbenzene is FC(F)(F)c1ccccc1.P.
What is the InChIKey of phosphane;trifluoromethylbenzene?
The InChIKey is HBPGLTVTYAJREM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F3.H3P/c8-7(9,10)6-4-2-1-3-5-6;/h1-5H;1H3.
What are the key properties of phosphane;trifluoromethylbenzene?
phosphane;trifluoromethylbenzene has a molecular weight of 180.11 g/mol, XLogP of 2.76, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for phosphane;trifluoromethylbenzene is sourced from PubChem (CID 175486194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).