magnesium;hydride;1-iodo-2,4-dimethylbenzene

C8H11IMg — CID 173036692

IUPACmagnesium;hydride;1-iodo-2,4-dimethylbenzene
SMILESCc1ccc(I)c(C)c1.[H-].[H-].[Mg+2]
InChIInChI=1S/C8H9I.Mg.2H/c1-6-3-4-8(9)7(2)5-6;;;/h3-5H,1-2H3;;;/q;+2;2*-1
InChIKeyHCPDBTPAPZHEFD-UHFFFAOYSA-N
MW258.38 g/mol
LogP2.75
Rot. Bonds

About magnesium;hydride;1-iodo-2,4-dimethylbenzene

magnesium;hydride;1-iodo-2,4-dimethylbenzene (PubChem CID 173036692) has the molecular formula C8H11IMg and a molecular weight of 258.38 g/mol. Its IUPAC name is magnesium;hydride;1-iodo-2,4-dimethylbenzene.

Molecular Properties

Compound Namemagnesium;hydride;1-iodo-2,4-dimethylbenzene
PubChem CID173036692
Molecular FormulaC8H11IMg
Molecular Weight258.38 g/mol
Exact Mass257.98
IUPAC Namemagnesium;hydride;1-iodo-2,4-dimethylbenzene
SMILESCc1ccc(I)c(C)c1.[H-].[H-].[Mg+2]
InChIInChI=1S/C8H9I.Mg.2H/c1-6-3-4-8(9)7(2)5-6;;;/h3-5H,1-2H3;;;/q;+2;2*-1
InChIKeyHCPDBTPAPZHEFD-UHFFFAOYSA-N
XLogP2.75
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.38
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1,2,4-trimethylbenzene
CID 7247
2-iodo-N,5-dimethyl-N-oxidoaniline
CID 163695309
1-iodo-4-[(4-iodo-3-methylphenyl)methyl]-2-methylbenzene
CID 130252033
1-iodo-2-methyl-4-(3-methylphenoxy)benzene
CID 135130038
1-iodo-4-methyl-2-propan-2-yloxybenzene
CID 164893598
1-iodo-2-(2-iodo-4-methylphenyl)-4-methylbenzene
CID 130307947
2-tert-butyl-1-iodo-4-methylbenzene
CID 146355198
4-(2,4-dimethylphenoxy)-3-iodoaniline
CID 66094612
azane;1,2,4-trimethylbenzene;hydrochloride
CID 174988554
N-(4-iodo-3-methylphenyl)-4-methylbenzenesulfonamide
CID 86078083
1-hydroxysulfanyl-2,4-dimethylbenzene
CID 117033827
2,4-dimethylphenol
CID 67713801

Frequently Asked Questions

What is the IUPAC name of magnesium;hydride;1-iodo-2,4-dimethylbenzene?
The IUPAC name of magnesium;hydride;1-iodo-2,4-dimethylbenzene (CID 173036692) is magnesium;hydride;1-iodo-2,4-dimethylbenzene.
What is the SMILES notation for magnesium;hydride;1-iodo-2,4-dimethylbenzene?
The canonical SMILES for magnesium;hydride;1-iodo-2,4-dimethylbenzene is Cc1ccc(I)c(C)c1.[H-].[H-].[Mg+2].
What is the InChIKey of magnesium;hydride;1-iodo-2,4-dimethylbenzene?
The InChIKey is HCPDBTPAPZHEFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9I.Mg.2H/c1-6-3-4-8(9)7(2)5-6;;;/h3-5H,1-2H3;;;/q;+2;2*-1.
What are the key properties of magnesium;hydride;1-iodo-2,4-dimethylbenzene?
magnesium;hydride;1-iodo-2,4-dimethylbenzene has a molecular weight of 258.38 g/mol, XLogP of 2.75, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;hydride;1-iodo-2,4-dimethylbenzene is sourced from PubChem (CID 173036692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).