magnesium;1-phenyl-4-propylbenzene;bromide

C15H16BrMg+ — CID 172966719

IUPACmagnesium;1-phenyl-4-propylbenzene;bromide
SMILESCCCc1ccc(-c2ccccc2)cc1.[Br-].[Mg+2]
InChIInChI=1S/C15H16.BrH.Mg/c1-2-6-13-9-11-15(12-10-13)14-7-4-3-5-8-14;;/h3-5,7-12H,2,6H2,1H3;1H;/q;;+2/p-1
InChIKeyZIFSBUCRUQXFAX-UHFFFAOYSA-M
MW300.50 g/mol
LogP0.93
Rot. Bonds3

About magnesium;1-phenyl-4-propylbenzene;bromide

magnesium;1-phenyl-4-propylbenzene;bromide (PubChem CID 172966719) has the molecular formula C15H16BrMg+ and a molecular weight of 300.50 g/mol. Its IUPAC name is magnesium;1-phenyl-4-propylbenzene;bromide.

Molecular Properties

Compound Namemagnesium;1-phenyl-4-propylbenzene;bromide
PubChem CID172966719
Molecular FormulaC15H16BrMg+
Molecular Weight300.50 g/mol
Exact Mass299.03
IUPAC Namemagnesium;1-phenyl-4-propylbenzene;bromide
SMILESCCCc1ccc(-c2ccccc2)cc1.[Br-].[Mg+2]
InChIInChI=1S/C15H16.BrH.Mg/c1-2-6-13-9-11-15(12-10-13)14-7-4-3-5-8-14;;/h3-5,7-12H,2,6H2,1H3;1H;/q;;+2/p-1
InChIKeyZIFSBUCRUQXFAX-UHFFFAOYSA-M
XLogP0.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.50
LogP ≤ 50.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-methyl-4-phenylbenzene;1-phenyl-4-propylbenzene
CID 143481088
CID 175306290
CID 175306290
ethane;2-methylbutane;1-phenyl-4-(4-propylphenyl)benzene
CID 144519167
1-butyl-4-phenylbenzene;ethane
CID 143743409
1-pentadecyl-4-phenylbenzene
CID 57166115
1-methyl-4-(4-propylphenyl)benzene
CID 157416879
1-ethyl-4-[4-(4-propylphenyl)phenyl]benzene
CID 58975771
1-methyl-4-phenyl-2-(4-propylphenyl)benzene
CID 123627409
propylbenzene;hydrobromide
CID 70024036
propylbenzene tetraiodide
CID 23321652
ethane;4-(4-hydroxyphenyl)phenol;propylbenzene
CID 174751919
1-(4-butylphenyl)-3-(3,5-diphenylphenyl)-5-phenylbenzene
CID 142551744

Frequently Asked Questions

What is the IUPAC name of magnesium;1-phenyl-4-propylbenzene;bromide?
The IUPAC name of magnesium;1-phenyl-4-propylbenzene;bromide (CID 172966719) is magnesium;1-phenyl-4-propylbenzene;bromide.
What is the SMILES notation for magnesium;1-phenyl-4-propylbenzene;bromide?
The canonical SMILES for magnesium;1-phenyl-4-propylbenzene;bromide is CCCc1ccc(-c2ccccc2)cc1.[Br-].[Mg+2].
What is the InChIKey of magnesium;1-phenyl-4-propylbenzene;bromide?
The InChIKey is ZIFSBUCRUQXFAX-UHFFFAOYSA-M. The full InChI is InChI=1S/C15H16.BrH.Mg/c1-2-6-13-9-11-15(12-10-13)14-7-4-3-5-8-14;;/h3-5,7-12H,2,6H2,1H3;1H;/q;;+2/p-1.
What are the key properties of magnesium;1-phenyl-4-propylbenzene;bromide?
magnesium;1-phenyl-4-propylbenzene;bromide has a molecular weight of 300.50 g/mol, XLogP of 0.93, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;1-phenyl-4-propylbenzene;bromide is sourced from PubChem (CID 172966719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).