magnesium;hydride;2-methyl-2-phenylpropanoic acid

C10H14MgO2 — CID 174669783

IUPACmagnesium;hydride;2-methyl-2-phenylpropanoic acid
SMILESCC(C)(C(=O)O)c1ccccc1.[H-].[H-].[Mg+2]
InChIInChI=1S/C10H12O2.Mg.2H/c1-10(2,9(11)12)8-6-4-3-5-7-8;;;/h3-7H,1-2H3,(H,11,12);;;/q;+2;2*-1
InChIKeyODHOVCUKTUTXHB-UHFFFAOYSA-N
MW190.53 g/mol
LogP1.89
Rot. Bonds2

About magnesium;hydride;2-methyl-2-phenylpropanoic acid

magnesium;hydride;2-methyl-2-phenylpropanoic acid (PubChem CID 174669783) has the molecular formula C10H14MgO2 and a molecular weight of 190.53 g/mol. Its IUPAC name is magnesium;hydride;2-methyl-2-phenylpropanoic acid.

Molecular Properties

Compound Namemagnesium;hydride;2-methyl-2-phenylpropanoic acid
PubChem CID174669783
Molecular FormulaC10H14MgO2
Molecular Weight190.53 g/mol
Exact Mass190.08
IUPAC Namemagnesium;hydride;2-methyl-2-phenylpropanoic acid
SMILESCC(C)(C(=O)O)c1ccccc1.[H-].[H-].[Mg+2]
InChIInChI=1S/C10H12O2.Mg.2H/c1-10(2,9(11)12)8-6-4-3-5-7-8;;;/h3-7H,1-2H3,(H,11,12);;;/q;+2;2*-1
InChIKeyODHOVCUKTUTXHB-UHFFFAOYSA-N
XLogP1.89
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.53
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

magnesium bis(2-methyl-2-phenylpropanoate)
CID 141248278
sodium 2-methyl-2-phenylpropanoate
CID 141248267
3-(2-carboxypropan-2-yl)benzoic acid
CID 19965411
ethane;2-hydroxy-2,2-diphenylacetic acid
CID 143307418
(2R)-2-hydroxy-2-phenylpropanoic acid
CID 736858
2-[4-[4-(2-carboxypropan-2-yl)phenyl]iodanuidylphenyl]-2-methylpropanoic acid
CID 140670155
2-(3-chlorophenyl)-2-methylpropanoic acid
CID 15582644
tert-butyl 3-methyl-2-oxo-3-phenylbutanoate
CID 158932795
magnesium;hydride;2-phenylpropan-2-ol
CID 175301380
lithium;potassium;2-tert-butyl-2-phenylpropanedioic acid;hydride
CID 174967974
2-hydroxy-N,N-dimethyl-2-phenylpropanamide
CID 121216825
[(2S)-3-methylbutan-2-yl] 2-methyl-2-phenylpropanoate
CID 118311634

Frequently Asked Questions

What is the IUPAC name of magnesium;hydride;2-methyl-2-phenylpropanoic acid?
The IUPAC name of magnesium;hydride;2-methyl-2-phenylpropanoic acid (CID 174669783) is magnesium;hydride;2-methyl-2-phenylpropanoic acid.
What is the SMILES notation for magnesium;hydride;2-methyl-2-phenylpropanoic acid?
The canonical SMILES for magnesium;hydride;2-methyl-2-phenylpropanoic acid is CC(C)(C(=O)O)c1ccccc1.[H-].[H-].[Mg+2].
What is the InChIKey of magnesium;hydride;2-methyl-2-phenylpropanoic acid?
The InChIKey is ODHOVCUKTUTXHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O2.Mg.2H/c1-10(2,9(11)12)8-6-4-3-5-7-8;;;/h3-7H,1-2H3,(H,11,12);;;/q;+2;2*-1.
What are the key properties of magnesium;hydride;2-methyl-2-phenylpropanoic acid?
magnesium;hydride;2-methyl-2-phenylpropanoic acid has a molecular weight of 190.53 g/mol, XLogP of 1.89, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;hydride;2-methyl-2-phenylpropanoic acid is sourced from PubChem (CID 174669783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).