magnesium;1-(bromomethyl)-4-fluorobenzene;hydride

C7H8BrFMg — CID 173010719

IUPACmagnesium;1-(bromomethyl)-4-fluorobenzene;hydride
SMILESFc1ccc(CBr)cc1.[H-].[H-].[Mg+2]
InChIInChI=1S/C7H6BrF.Mg.2H/c8-5-6-1-3-7(9)4-2-6;;;/h1-4H,5H2;;;/q;+2;2*-1
InChIKeyGPQOMQNLRLCDGS-UHFFFAOYSA-N
MW215.35 g/mol
LogP2.56
Rot. Bonds1

About magnesium;1-(bromomethyl)-4-fluorobenzene;hydride

magnesium;1-(bromomethyl)-4-fluorobenzene;hydride (PubChem CID 173010719) has the molecular formula C7H8BrFMg and a molecular weight of 215.35 g/mol. Its IUPAC name is magnesium;1-(bromomethyl)-4-fluorobenzene;hydride.

Molecular Properties

Compound Namemagnesium;1-(bromomethyl)-4-fluorobenzene;hydride
PubChem CID173010719
Molecular FormulaC7H8BrFMg
Molecular Weight215.35 g/mol
Exact Mass213.96
IUPAC Namemagnesium;1-(bromomethyl)-4-fluorobenzene;hydride
SMILESFc1ccc(CBr)cc1.[H-].[H-].[Mg+2]
InChIInChI=1S/C7H6BrF.Mg.2H/c8-5-6-1-3-7(9)4-2-6;;;/h1-4H,5H2;;;/q;+2;2*-1
InChIKeyGPQOMQNLRLCDGS-UHFFFAOYSA-N
XLogP2.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.35
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze magnesium;1-(bromomethyl)-4-fluorobenzene;hydride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(bromomethyl)-4-fluorobenzene;2,2-difluoropropane
CID 160651614
4-(bromomethyl)-N-[(4-fluorophenyl)methyl]benzenesulfonamide
CID 57017783
N-[4-(bromomethyl)phenyl]-4-fluorobenzenesulfonamide
CID 18629013
2-(bromomethyl)-7-fluoronaphthalene
CID 23292295
1-[3-bromo-2-(bromomethyl)propyl]-4-fluorobenzene
CID 79452753
ethane;(4-fluorophenyl)methanamine
CID 142071105
4-(bromomethyl)-N-[2-(4-fluorophenyl)ethyl]benzamide
CID 11131484
4-(bromomethyl)-2-fluoro-1-[(4-fluorophenyl)methoxy]benzene
CID 107691588
N-(bromomethyl)-1-(4-fluorophenyl)-N-methylmethanamine
CID 115261999
1-(bromomethyl)-4-methylsulfanylbenzene
CID 11367930
CID 57470384
CID 57470384
[4-(bromomethyl)phenyl]methanamine
CID 24721042

Frequently Asked Questions

What is the IUPAC name of magnesium;1-(bromomethyl)-4-fluorobenzene;hydride?
The IUPAC name of magnesium;1-(bromomethyl)-4-fluorobenzene;hydride (CID 173010719) is magnesium;1-(bromomethyl)-4-fluorobenzene;hydride.
What is the SMILES notation for magnesium;1-(bromomethyl)-4-fluorobenzene;hydride?
The canonical SMILES for magnesium;1-(bromomethyl)-4-fluorobenzene;hydride is Fc1ccc(CBr)cc1.[H-].[H-].[Mg+2].
What is the InChIKey of magnesium;1-(bromomethyl)-4-fluorobenzene;hydride?
The InChIKey is GPQOMQNLRLCDGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6BrF.Mg.2H/c8-5-6-1-3-7(9)4-2-6;;;/h1-4H,5H2;;;/q;+2;2*-1.
What are the key properties of magnesium;1-(bromomethyl)-4-fluorobenzene;hydride?
magnesium;1-(bromomethyl)-4-fluorobenzene;hydride has a molecular weight of 215.35 g/mol, XLogP of 2.56, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;1-(bromomethyl)-4-fluorobenzene;hydride is sourced from PubChem (CID 173010719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).