magnesium;hydride;2-phenylpropan-2-ol

C9H14MgO — CID 175301380

IUPACmagnesium;hydride;2-phenylpropan-2-ol
SMILESCC(C)(O)c1ccccc1.[H-].[H-].[Mg+2]
InChIInChI=1S/C9H12O.Mg.2H/c1-9(2,10)8-6-4-3-5-7-8;;;/h3-7,10H,1-2H3;;;/q;+2;2*-1
InChIKeyAYXAOVBSEPBJOH-UHFFFAOYSA-N
MW162.52 g/mol
LogP1.76
Rot. Bonds1

About magnesium;hydride;2-phenylpropan-2-ol

magnesium;hydride;2-phenylpropan-2-ol (PubChem CID 175301380) has the molecular formula C9H14MgO and a molecular weight of 162.52 g/mol. Its IUPAC name is magnesium;hydride;2-phenylpropan-2-ol.

Molecular Properties

Compound Namemagnesium;hydride;2-phenylpropan-2-ol
PubChem CID175301380
Molecular FormulaC9H14MgO
Molecular Weight162.52 g/mol
Exact Mass162.09
IUPAC Namemagnesium;hydride;2-phenylpropan-2-ol
SMILESCC(C)(O)c1ccccc1.[H-].[H-].[Mg+2]
InChIInChI=1S/C9H12O.Mg.2H/c1-9(2,10)8-6-4-3-5-7-8;;;/h3-7,10H,1-2H3;;;/q;+2;2*-1
InChIKeyAYXAOVBSEPBJOH-UHFFFAOYSA-N
XLogP1.76
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.52
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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1-phenylpropan-1-ol;2-phenylpropan-2-ol
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(2S,4R)-2,4-diphenylpentane-2,4-diol
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magnesium;hydride;2-methyl-2-phenylpropanoic acid
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sodium;hydride;triphenylmethanol
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2-[3,5-bis(2-hydroxypropan-2-yl)phenyl]propan-2-ol;2-[4-(2-hydroxypropan-2-yl)phenyl]propan-2-ol
CID 67743225
1-[2-(1-hydroxy-1-phenylethyl)phenyl]-1-phenylethanol
CID 139663259
2-phenylpropan-2-ylbenzene
CID 13065
CID 171375456
CID 171375456
hydrogen peroxide;2,3,3-trimethylbutan-2-ylbenzene
CID 23026515
lithium;tert-butylbenzene;hydride;sulfuric acid
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(2R)-2-hydroxy-2-phenylpropanoic acid
CID 736858

Frequently Asked Questions

What is the IUPAC name of magnesium;hydride;2-phenylpropan-2-ol?
The IUPAC name of magnesium;hydride;2-phenylpropan-2-ol (CID 175301380) is magnesium;hydride;2-phenylpropan-2-ol.
What is the SMILES notation for magnesium;hydride;2-phenylpropan-2-ol?
The canonical SMILES for magnesium;hydride;2-phenylpropan-2-ol is CC(C)(O)c1ccccc1.[H-].[H-].[Mg+2].
What is the InChIKey of magnesium;hydride;2-phenylpropan-2-ol?
The InChIKey is AYXAOVBSEPBJOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12O.Mg.2H/c1-9(2,10)8-6-4-3-5-7-8;;;/h3-7,10H,1-2H3;;;/q;+2;2*-1.
What are the key properties of magnesium;hydride;2-phenylpropan-2-ol?
magnesium;hydride;2-phenylpropan-2-ol has a molecular weight of 162.52 g/mol, XLogP of 1.76, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;hydride;2-phenylpropan-2-ol is sourced from PubChem (CID 175301380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).