magnesium;chloromethane;hydride

CH5ClMg — CID 172997895

IUPACmagnesium;chloromethane;hydride
SMILESCCl.[H-].[H-].[Mg+2]
InChIInChI=1S/CH3Cl.Mg.2H/c1-2;;;/h1H3;;;/q;+2;2*-1
InChIKeyAGTAISAVDAHIKE-UHFFFAOYSA-N
MW76.81 g/mol
LogP0.70
Rot. Bonds

About magnesium;chloromethane;hydride

magnesium;chloromethane;hydride (PubChem CID 172997895) has the molecular formula CH5ClMg and a molecular weight of 76.81 g/mol. Its IUPAC name is magnesium;chloromethane;hydride.

Molecular Properties

Compound Namemagnesium;chloromethane;hydride
PubChem CID172997895
Molecular FormulaCH5ClMg
Molecular Weight76.81 g/mol
Exact Mass75.99
IUPAC Namemagnesium;chloromethane;hydride
SMILESCCl.[H-].[H-].[Mg+2]
InChIInChI=1S/CH3Cl.Mg.2H/c1-2;;;/h1H3;;;/q;+2;2*-1
InChIKeyAGTAISAVDAHIKE-UHFFFAOYSA-N
XLogP0.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50076.81
LogP ≤ 50.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of magnesium;chloromethane;hydride?
The IUPAC name of magnesium;chloromethane;hydride (CID 172997895) is magnesium;chloromethane;hydride.
What is the SMILES notation for magnesium;chloromethane;hydride?
The canonical SMILES for magnesium;chloromethane;hydride is CCl.[H-].[H-].[Mg+2].
What is the InChIKey of magnesium;chloromethane;hydride?
The InChIKey is AGTAISAVDAHIKE-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3Cl.Mg.2H/c1-2;;;/h1H3;;;/q;+2;2*-1.
What are the key properties of magnesium;chloromethane;hydride?
magnesium;chloromethane;hydride has a molecular weight of 76.81 g/mol, XLogP of 0.70, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;chloromethane;hydride is sourced from PubChem (CID 172997895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).