1-chloro-4-(trifluoromethyl)benzene-6-ide;iodomanganese(1+)

C7H3ClF3IMn — CID 169034021

IUPAC1-chloro-4-(trifluoromethyl)benzene-6-ide;iodomanganese(1+)
SMILESFC(F)(F)c1c[c-]c(Cl)cc1.[Mn+]I
InChIInChI=1S/C7H3ClF3.HI.Mn/c8-6-3-1-5(2-4-6)7(9,10)11;;/h1-3H;1H;/q-1;;+2/p-1
InChIKeyFOYIGTLBHPMOIM-UHFFFAOYSA-M
MW361.39 g/mol
LogP4.04
Rot. Bonds

About 1-chloro-4-(trifluoromethyl)benzene-6-ide;iodomanganese(1+)

1-chloro-4-(trifluoromethyl)benzene-6-ide;iodomanganese(1+) (PubChem CID 169034021) has the molecular formula C7H3ClF3IMn and a molecular weight of 361.39 g/mol. Its IUPAC name is 1-chloro-4-(trifluoromethyl)benzene-6-ide;iodomanganese(1+).

Molecular Properties

Compound Name1-chloro-4-(trifluoromethyl)benzene-6-ide;iodomanganese(1+)
PubChem CID169034021
Molecular FormulaC7H3ClF3IMn
Molecular Weight361.39 g/mol
Exact Mass360.83
IUPAC Name1-chloro-4-(trifluoromethyl)benzene-6-ide;iodomanganese(1+)
SMILESFC(F)(F)c1c[c-]c(Cl)cc1.[Mn+]I
InChIInChI=1S/C7H3ClF3.HI.Mn/c8-6-3-1-5(2-4-6)7(9,10)11;;/h1-3H;1H;/q-1;;+2/p-1
InChIKeyFOYIGTLBHPMOIM-UHFFFAOYSA-M
XLogP4.04
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.39
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-chloro-4-(trifluoromethyl)benzene-6-ide;iodomanganese(1+)?
The IUPAC name of 1-chloro-4-(trifluoromethyl)benzene-6-ide;iodomanganese(1+) (CID 169034021) is 1-chloro-4-(trifluoromethyl)benzene-6-ide;iodomanganese(1+).
What is the SMILES notation for 1-chloro-4-(trifluoromethyl)benzene-6-ide;iodomanganese(1+)?
The canonical SMILES for 1-chloro-4-(trifluoromethyl)benzene-6-ide;iodomanganese(1+) is FC(F)(F)c1c[c-]c(Cl)cc1.[Mn+]I.
What is the InChIKey of 1-chloro-4-(trifluoromethyl)benzene-6-ide;iodomanganese(1+)?
The InChIKey is FOYIGTLBHPMOIM-UHFFFAOYSA-M. The full InChI is InChI=1S/C7H3ClF3.HI.Mn/c8-6-3-1-5(2-4-6)7(9,10)11;;/h1-3H;1H;/q-1;;+2/p-1.
What are the key properties of 1-chloro-4-(trifluoromethyl)benzene-6-ide;iodomanganese(1+)?
1-chloro-4-(trifluoromethyl)benzene-6-ide;iodomanganese(1+) has a molecular weight of 361.39 g/mol, XLogP of 4.04, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-4-(trifluoromethyl)benzene-6-ide;iodomanganese(1+) is sourced from PubChem (CID 169034021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).