ethane;1-methyl-2-phenylbenzene-3-ide;1-methyl-3-phenylbenzene-2-ide;1-methyl-3-phenylbenzene-4-ide;1-methyl-4-phenylbenzene-5-ide;1-phenyl-3-phenylbenzene-2-ide;4-phenyl-1-phenylbenzene-6-ide;hexakis(yttrium)

C132H196Y6-12 — CID 158811624

About ethane;1-methyl-2-phenylbenzene-3-ide;1-methyl-3-phenylbenzene-2-ide;1-methyl-3-phenylbenzene-4-ide;1-methyl-4-phenylbenzene-5-ide;1-phenyl-3-phenylbenzene-2-ide;4-phenyl-1-phenylbenzene-6-ide;hexakis(yttrium)

ethane;1-methyl-2-phenylbenzene-3-ide;1-methyl-3-phenylbenzene-2-ide;1-methyl-3-phenylbenzene-4-ide;1-methyl-4-phenylbenzene-5-ide;1-phenyl-3-phenylbenzene-2-ide;4-phenyl-1-phenylbenzene-6-ide;hexakis(yttrium) (PubChem CID 158811624) has the molecular formula C132H196Y6-12 and a molecular weight of 2316.46 g/mol. Its IUPAC name is ethane;1-methyl-2-phenylbenzene-3-ide;1-methyl-3-phenylbenzene-2-ide;1-methyl-3-phenylbenzene-4-ide;1-methyl-4-phenylbenzene-5-ide;1-phenyl-3-phenylbenzene-2-ide;4-phenyl-1-phenylbenzene-6-ide;hexakis(yttrium).

Molecular Properties

• Compound Name: ethane;1-methyl-2-phenylbenzene-3-ide;1-methyl-3-phenylbenzene-2-ide;1-methyl-3-phenylbenzene-4-ide;1-methyl-4-phenylbenzene-5-ide;1-phenyl-3-phenylbenzene-2-ide;4-phenyl-1-phenylbenzene-6-ide;hexakis(yttrium)
• PubChem CID: 158811624
• Molecular Formula: C132H196Y6-12
• Molecular Weight: 2316.46 g/mol
• Exact Mass: 2314.98
• IUPAC Name: ethane;1-methyl-2-phenylbenzene-3-ide;1-methyl-3-phenylbenzene-2-ide;1-methyl-3-phenylbenzene-4-ide;1-methyl-4-phenylbenzene-5-ide;1-phenyl-3-phenylbenzene-2-ide;4-phenyl-1-phenylbenzene-6-ide;hexakis(yttrium)
• SMILES: CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.Cc1[c-]c(-c2[c-]cccc2)ccc1.Cc1c[c-]c(-c2[c-]cccc2)cc1.Cc1cc[c-]c(-c2[c-]cccc2)c1.Cc1ccc[c-]c1-c1[c-]cccc1.[Y].[Y].[Y].[Y].[Y].[Y].[c-]1ccccc1-c1[c-]c(-c2ccccc2)ccc1.[c-]1ccccc1-c1[c-]cc(-c2ccccc2)cc1
• InChI: InChI=1S/2C18H12.4C13H10.22C2H6.6Y/c1-3-8-15(9-4-1)17-12-7-13-18(14-17)16-10-5-2-6-11-16;1-3-7-15(8-4-1)17-11-13-18(14-12-17)16-9-5-2-6-10-16;1-11-7-5-6-10-13(11)12-8-3-2-4-9-12;2*1-11-6-5-9-13(10-11)12-7-3-2-4-8-12;1-11-7-9-13(10-8-11)12-5-3-2-4-6-12;22*1-2;;;;;;/h1-10,12-13H;1-9,11-13H;2-8H,1H3;2-7,10H,1H3;2-7,9H,1H3;2-5,7-9H,1H3;22*1-2H3;;;;;;/q6*-2
• InChIKey: KQZKWPCFNJMZLZ-UHFFFAOYSA-N
• XLogP: 44.85
• TPSA: 0.00 Ų
• Rotatable Bonds: 8
• Heavy Atoms: 138
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2316.46
LogP ≤ 5	44.85
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of ethane;1-methyl-2-phenylbenzene-3-ide;1-methyl-3-phenylbenzene-2-ide;1-methyl-3-phenylbenzene-4-ide;1-methyl-4-phenylbenzene-5-ide;1-phenyl-3-phenylbenzene-2-ide;4-phenyl-1-phenylbenzene-6-ide;hexakis(yttrium)?

The IUPAC name of ethane;1-methyl-2-phenylbenzene-3-ide;1-methyl-3-phenylbenzene-2-ide;1-methyl-3-phenylbenzene-4-ide;1-methyl-4-phenylbenzene-5-ide;1-phenyl-3-phenylbenzene-2-ide;4-phenyl-1-phenylbenzene-6-ide;hexakis(yttrium) (CID 158811624) is ethane;1-methyl-2-phenylbenzene-3-ide;1-methyl-3-phenylbenzene-2-ide;1-methyl-3-phenylbenzene-4-ide;1-methyl-4-phenylbenzene-5-ide;1-phenyl-3-phenylbenzene-2-ide;4-phenyl-1-phenylbenzene-6-ide;hexakis(yttrium).

What is the SMILES notation for ethane;1-methyl-2-phenylbenzene-3-ide;1-methyl-3-phenylbenzene-2-ide;1-methyl-3-phenylbenzene-4-ide;1-methyl-4-phenylbenzene-5-ide;1-phenyl-3-phenylbenzene-2-ide;4-phenyl-1-phenylbenzene-6-ide;hexakis(yttrium)?

The canonical SMILES for ethane;1-methyl-2-phenylbenzene-3-ide;1-methyl-3-phenylbenzene-2-ide;1-methyl-3-phenylbenzene-4-ide;1-methyl-4-phenylbenzene-5-ide;1-phenyl-3-phenylbenzene-2-ide;4-phenyl-1-phenylbenzene-6-ide;hexakis(yttrium) is CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.Cc1[c-]c(-c2[c-]cccc2)ccc1.Cc1c[c-]c(-c2[c-]cccc2)cc1.Cc1cc[c-]c(-c2[c-]cccc2)c1.Cc1ccc[c-]c1-c1[c-]cccc1.[Y].[Y].[Y].[Y].[Y].[Y].[c-]1ccccc1-c1[c-]c(-c2ccccc2)ccc1.[c-]1ccccc1-c1[c-]cc(-c2ccccc2)cc1.

What is the InChIKey of ethane;1-methyl-2-phenylbenzene-3-ide;1-methyl-3-phenylbenzene-2-ide;1-methyl-3-phenylbenzene-4-ide;1-methyl-4-phenylbenzene-5-ide;1-phenyl-3-phenylbenzene-2-ide;4-phenyl-1-phenylbenzene-6-ide;hexakis(yttrium)?

The InChIKey is KQZKWPCFNJMZLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C18H12.4C13H10.22C2H6.6Y/c1-3-8-15(9-4-1)17-12-7-13-18(14-17)16-10-5-2-6-11-16;1-3-7-15(8-4-1)17-11-13-18(14-12-17)16-9-5-2-6-10-16;1-11-7-5-6-10-13(11)12-8-3-2-4-9-12;2*1-11-6-5-9-13(10-11)12-7-3-2-4-8-12;1-11-7-9-13(10-8-11)12-5-3-2-4-6-12;22*1-2;;;;;;/h1-10,12-13H;1-9,11-13H;2-8H,1H3;2-7,10H,1H3;2-7,9H,1H3;2-5,7-9H,1H3;22*1-2H3;;;;;;/q6*-2;;;;;;;;;;;;;;;;;;;;;;;;;;;;.

What are the key properties of ethane;1-methyl-2-phenylbenzene-3-ide;1-methyl-3-phenylbenzene-2-ide;1-methyl-3-phenylbenzene-4-ide;1-methyl-4-phenylbenzene-5-ide;1-phenyl-3-phenylbenzene-2-ide;4-phenyl-1-phenylbenzene-6-ide;hexakis(yttrium)?

ethane;1-methyl-2-phenylbenzene-3-ide;1-methyl-3-phenylbenzene-2-ide;1-methyl-3-phenylbenzene-4-ide;1-methyl-4-phenylbenzene-5-ide;1-phenyl-3-phenylbenzene-2-ide;4-phenyl-1-phenylbenzene-6-ide;hexakis(yttrium) has a molecular weight of 2316.46 g/mol, XLogP of 44.85, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for ethane;1-methyl-2-phenylbenzene-3-ide;1-methyl-3-phenylbenzene-2-ide;1-methyl-3-phenylbenzene-4-ide;1-methyl-4-phenylbenzene-5-ide;1-phenyl-3-phenylbenzene-2-ide;4-phenyl-1-phenylbenzene-6-ide;hexakis(yttrium) is sourced from PubChem (CID 158811624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).