1,3-difluorobenzene-2-ide;manganese

C6H3F2Mn- — CID 135025289

IUPAC1,3-difluorobenzene-2-ide;manganese
SMILESFc1[c-]c(F)ccc1.[Mn]
InChIInChI=1S/C6H3F2.Mn/c7-5-2-1-3-6(8)4-5;/h1-3H;/q-1;
InChIKeyBLBIBMXVGORGBF-UHFFFAOYSA-N
MW168.02 g/mol
LogP1.76
Rot. Bonds

About 1,3-difluorobenzene-2-ide;manganese

1,3-difluorobenzene-2-ide;manganese (PubChem CID 135025289) has the molecular formula C6H3F2Mn- and a molecular weight of 168.02 g/mol. Its IUPAC name is 1,3-difluorobenzene-2-ide;manganese.

Molecular Properties

Compound Name1,3-difluorobenzene-2-ide;manganese
PubChem CID135025289
Molecular FormulaC6H3F2Mn-
Molecular Weight168.02 g/mol
Exact Mass167.96
IUPAC Name1,3-difluorobenzene-2-ide;manganese
SMILESFc1[c-]c(F)ccc1.[Mn]
InChIInChI=1S/C6H3F2.Mn/c7-5-2-1-3-6(8)4-5;/h1-3H;/q-1;
InChIKeyBLBIBMXVGORGBF-UHFFFAOYSA-N
XLogP1.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.02
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,3-difluorobenzene-2-ide;manganese?
The IUPAC name of 1,3-difluorobenzene-2-ide;manganese (CID 135025289) is 1,3-difluorobenzene-2-ide;manganese.
What is the SMILES notation for 1,3-difluorobenzene-2-ide;manganese?
The canonical SMILES for 1,3-difluorobenzene-2-ide;manganese is Fc1[c-]c(F)ccc1.[Mn].
What is the InChIKey of 1,3-difluorobenzene-2-ide;manganese?
The InChIKey is BLBIBMXVGORGBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3F2.Mn/c7-5-2-1-3-6(8)4-5;/h1-3H;/q-1;.
What are the key properties of 1,3-difluorobenzene-2-ide;manganese?
1,3-difluorobenzene-2-ide;manganese has a molecular weight of 168.02 g/mol, XLogP of 1.76, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-difluorobenzene-2-ide;manganese is sourced from PubChem (CID 135025289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).