magnesium;2,6-bis(4-bromophenyl)-4-(4-phenylphenyl)pyridine;bis(3,5-difluorophenyl)-oxophosphanium;N-bis(3,5-difluorophenyl)phosphanyl-N-methylmethanamine;1-bromo-3,5-difluorobenzene;1-(4-bromophenyl)ethanone;N-dichlorophosphanyl-N-methylmethanamine;hydride;4-phenylbenzaldehyde

C84H65Br4Cl2F10MgN3O3P3+ — CID 157194099

About magnesium;2,6-bis(4-bromophenyl)-4-(4-phenylphenyl)pyridine;bis(3,5-difluorophenyl)-oxophosphanium;N-bis(3,5-difluorophenyl)phosphanyl-N-methylmethanamine;1-bromo-3,5-difluorobenzene;1-(4-bromophenyl)ethanone;N-dichlorophosphanyl-N-methylmethanamine;hydride;4-phenylbenzaldehyde

magnesium;2,6-bis(4-bromophenyl)-4-(4-phenylphenyl)pyridine;bis(3,5-difluorophenyl)-oxophosphanium;N-bis(3,5-difluorophenyl)phosphanyl-N-methylmethanamine;1-bromo-3,5-difluorobenzene;1-(4-bromophenyl)ethanone;N-dichlorophosphanyl-N-methylmethanamine;hydride;4-phenylbenzaldehyde (PubChem CID 157194099) has the molecular formula C84H65Br4Cl2F10MgN3O3P3+ and a molecular weight of 1862.19 g/mol. Its IUPAC name is magnesium;2,6-bis(4-bromophenyl)-4-(4-phenylphenyl)pyridine;bis(3,5-difluorophenyl)-oxophosphanium;N-bis(3,5-difluorophenyl)phosphanyl-N-methylmethanamine;1-bromo-3,5-difluorobenzene;1-(4-bromophenyl)ethanone;N-dichlorophosphanyl-N-methylmethanamine;hydride;4-phenylbenzaldehyde.

Molecular Properties

• Compound Name: magnesium;2,6-bis(4-bromophenyl)-4-(4-phenylphenyl)pyridine;bis(3,5-difluorophenyl)-oxophosphanium;N-bis(3,5-difluorophenyl)phosphanyl-N-methylmethanamine;1-bromo-3,5-difluorobenzene;1-(4-bromophenyl)ethanone;N-dichlorophosphanyl-N-methylmethanamine;hydride;4-phenylbenzaldehyde
• PubChem CID: 157194099
• Molecular Formula: C84H65Br4Cl2F10MgN3O3P3+
• Molecular Weight: 1862.19 g/mol
• Exact Mass: 1856.00
• IUPAC Name: magnesium;2,6-bis(4-bromophenyl)-4-(4-phenylphenyl)pyridine;bis(3,5-difluorophenyl)-oxophosphanium;N-bis(3,5-difluorophenyl)phosphanyl-N-methylmethanamine;1-bromo-3,5-difluorobenzene;1-(4-bromophenyl)ethanone;N-dichlorophosphanyl-N-methylmethanamine;hydride;4-phenylbenzaldehyde
• SMILES: Brc1ccc(-c2cc(-c3ccc(-c4ccccc4)cc3)cc(-c3ccc(Br)cc3)n2)cc1.CC(=O)c1ccc(Br)cc1.CN(C)P(Cl)Cl.CN(C)P(c1cc(F)cc(F)c1)c1cc(F)cc(F)c1.Fc1cc(F)cc(Br)c1.O=Cc1ccc(-c2ccccc2)cc1.O=[P+](c1cc(F)cc(F)c1)c1cc(F)cc(F)c1.[H-].[H-].[Mg+2]
• InChI: InChI=1S/C29H19Br2N.C14H12F4NP.C13H10O.C12H6F4OP.C8H7BrO.C6H3BrF2.C2H6Cl2NP.Mg.2H/c30-26-14-10-23(11-15-26)28-18-25(19-29(32-28)24-12-16-27(31)17-13-24)22-8-6-21(7-9-22)20-4-2-1-3-5-20;1-19(2)20(13-5-9(15)3-10(16)6-13)14-7-11(17)4-12(18)8-14;14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12;13-7-1-8(14)4-11(3-7)18(17)12-5-9(15)2-10(16)6-12;1-6(10)7-2-4-8(9)5-3-7;7-4-1-5(8)3-6(9)2-4;1-5(2)6(3)4;;;/h1-19H;3-8H,1-2H3;1-10H;1-6H;2-5H,1H3;1-3H;1-2H3;;;/q;;;+1;;;;+2;2*-1
• InChIKey: XMWCZXPGYPKTMV-UHFFFAOYSA-N
• XLogP: 26.09
• TPSA: 70.58 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 13
• Heavy Atoms: 110
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1862.19
LogP ≤ 5	26.09
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of magnesium;2,6-bis(4-bromophenyl)-4-(4-phenylphenyl)pyridine;bis(3,5-difluorophenyl)-oxophosphanium;N-bis(3,5-difluorophenyl)phosphanyl-N-methylmethanamine;1-bromo-3,5-difluorobenzene;1-(4-bromophenyl)ethanone;N-dichlorophosphanyl-N-methylmethanamine;hydride;4-phenylbenzaldehyde?

The IUPAC name of magnesium;2,6-bis(4-bromophenyl)-4-(4-phenylphenyl)pyridine;bis(3,5-difluorophenyl)-oxophosphanium;N-bis(3,5-difluorophenyl)phosphanyl-N-methylmethanamine;1-bromo-3,5-difluorobenzene;1-(4-bromophenyl)ethanone;N-dichlorophosphanyl-N-methylmethanamine;hydride;4-phenylbenzaldehyde (CID 157194099) is magnesium;2,6-bis(4-bromophenyl)-4-(4-phenylphenyl)pyridine;bis(3,5-difluorophenyl)-oxophosphanium;N-bis(3,5-difluorophenyl)phosphanyl-N-methylmethanamine;1-bromo-3,5-difluorobenzene;1-(4-bromophenyl)ethanone;N-dichlorophosphanyl-N-methylmethanamine;hydride;4-phenylbenzaldehyde.

What is the SMILES notation for magnesium;2,6-bis(4-bromophenyl)-4-(4-phenylphenyl)pyridine;bis(3,5-difluorophenyl)-oxophosphanium;N-bis(3,5-difluorophenyl)phosphanyl-N-methylmethanamine;1-bromo-3,5-difluorobenzene;1-(4-bromophenyl)ethanone;N-dichlorophosphanyl-N-methylmethanamine;hydride;4-phenylbenzaldehyde?

The canonical SMILES for magnesium;2,6-bis(4-bromophenyl)-4-(4-phenylphenyl)pyridine;bis(3,5-difluorophenyl)-oxophosphanium;N-bis(3,5-difluorophenyl)phosphanyl-N-methylmethanamine;1-bromo-3,5-difluorobenzene;1-(4-bromophenyl)ethanone;N-dichlorophosphanyl-N-methylmethanamine;hydride;4-phenylbenzaldehyde is Brc1ccc(-c2cc(-c3ccc(-c4ccccc4)cc3)cc(-c3ccc(Br)cc3)n2)cc1.CC(=O)c1ccc(Br)cc1.CN(C)P(Cl)Cl.CN(C)P(c1cc(F)cc(F)c1)c1cc(F)cc(F)c1.Fc1cc(F)cc(Br)c1.O=Cc1ccc(-c2ccccc2)cc1.O=[P+](c1cc(F)cc(F)c1)c1cc(F)cc(F)c1.[H-].[H-].[Mg+2].

What is the InChIKey of magnesium;2,6-bis(4-bromophenyl)-4-(4-phenylphenyl)pyridine;bis(3,5-difluorophenyl)-oxophosphanium;N-bis(3,5-difluorophenyl)phosphanyl-N-methylmethanamine;1-bromo-3,5-difluorobenzene;1-(4-bromophenyl)ethanone;N-dichlorophosphanyl-N-methylmethanamine;hydride;4-phenylbenzaldehyde?

The InChIKey is XMWCZXPGYPKTMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H19Br2N.C14H12F4NP.C13H10O.C12H6F4OP.C8H7BrO.C6H3BrF2.C2H6Cl2NP.Mg.2H/c30-26-14-10-23(11-15-26)28-18-25(19-29(32-28)24-12-16-27(31)17-13-24)22-8-6-21(7-9-22)20-4-2-1-3-5-20;1-19(2)20(13-5-9(15)3-10(16)6-13)14-7-11(17)4-12(18)8-14;14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12;13-7-1-8(14)4-11(3-7)18(17)12-5-9(15)2-10(16)6-12;1-6(10)7-2-4-8(9)5-3-7;7-4-1-5(8)3-6(9)2-4;1-5(2)6(3)4;;;/h1-19H;3-8H,1-2H3;1-10H;1-6H;2-5H,1H3;1-3H;1-2H3;;;/q;;;+1;;;;+2;2*-1.

What are the key properties of magnesium;2,6-bis(4-bromophenyl)-4-(4-phenylphenyl)pyridine;bis(3,5-difluorophenyl)-oxophosphanium;N-bis(3,5-difluorophenyl)phosphanyl-N-methylmethanamine;1-bromo-3,5-difluorobenzene;1-(4-bromophenyl)ethanone;N-dichlorophosphanyl-N-methylmethanamine;hydride;4-phenylbenzaldehyde?

magnesium;2,6-bis(4-bromophenyl)-4-(4-phenylphenyl)pyridine;bis(3,5-difluorophenyl)-oxophosphanium;N-bis(3,5-difluorophenyl)phosphanyl-N-methylmethanamine;1-bromo-3,5-difluorobenzene;1-(4-bromophenyl)ethanone;N-dichlorophosphanyl-N-methylmethanamine;hydride;4-phenylbenzaldehyde has a molecular weight of 1862.19 g/mol, XLogP of 26.09, 13 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for magnesium;2,6-bis(4-bromophenyl)-4-(4-phenylphenyl)pyridine;bis(3,5-difluorophenyl)-oxophosphanium;N-bis(3,5-difluorophenyl)phosphanyl-N-methylmethanamine;1-bromo-3,5-difluorobenzene;1-(4-bromophenyl)ethanone;N-dichlorophosphanyl-N-methylmethanamine;hydride;4-phenylbenzaldehyde is sourced from PubChem (CID 157194099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).