fluorobenzene;zinc;hydrobromide

C6H5BrFZn- — CID 87180748

IUPACfluorobenzene;zinc;hydrobromide
SMILESBr.Fc1cc[c-]cc1.[Zn]
InChIInChI=1S/C6H4F.BrH.Zn/c7-6-4-2-1-3-5-6;;/h2-5H;1H;/q-1;;
InChIKeyIKDXZSSDSMKDKW-UHFFFAOYSA-N
MW241.40 g/mol
LogP2.20
Rot. Bonds

About fluorobenzene;zinc;hydrobromide

fluorobenzene;zinc;hydrobromide (PubChem CID 87180748) has the molecular formula C6H5BrFZn- and a molecular weight of 241.40 g/mol. Its IUPAC name is fluorobenzene;zinc;hydrobromide.

Molecular Properties

Compound Namefluorobenzene;zinc;hydrobromide
PubChem CID87180748
Molecular FormulaC6H5BrFZn-
Molecular Weight241.40 g/mol
Exact Mass238.89
IUPAC Namefluorobenzene;zinc;hydrobromide
SMILESBr.Fc1cc[c-]cc1.[Zn]
InChIInChI=1S/C6H4F.BrH.Zn/c7-6-4-2-1-3-5-6;;/h2-5H;1H;/q-1;;
InChIKeyIKDXZSSDSMKDKW-UHFFFAOYSA-N
XLogP2.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.40
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of fluorobenzene;zinc;hydrobromide?
The IUPAC name of fluorobenzene;zinc;hydrobromide (CID 87180748) is fluorobenzene;zinc;hydrobromide.
What is the SMILES notation for fluorobenzene;zinc;hydrobromide?
The canonical SMILES for fluorobenzene;zinc;hydrobromide is Br.Fc1cc[c-]cc1.[Zn].
What is the InChIKey of fluorobenzene;zinc;hydrobromide?
The InChIKey is IKDXZSSDSMKDKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4F.BrH.Zn/c7-6-4-2-1-3-5-6;;/h2-5H;1H;/q-1;;.
What are the key properties of fluorobenzene;zinc;hydrobromide?
fluorobenzene;zinc;hydrobromide has a molecular weight of 241.40 g/mol, XLogP of 2.20, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for fluorobenzene;zinc;hydrobromide is sourced from PubChem (CID 87180748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).