ethane;2-methylprop-2-enylideneazanide;9-methylspiro[benzo[a]fluorene-11,9'-fluorene];2-methylspiro[benzo[b]fluorene-11,9'-fluorene];9-methylspiro[benzo[c]fluorene-7,9'-fluorene];(yttrium)

C120H143NY31-2 — CID 161073358

About ethane;2-methylprop-2-enylideneazanide;9-methylspiro[benzo[a]fluorene-11,9'-fluorene];2-methylspiro[benzo[b]fluorene-11,9'-fluorene];9-methylspiro[benzo[c]fluorene-7,9'-fluorene];(yttrium)

ethane;2-methylprop-2-enylideneazanide;9-methylspiro[benzo[a]fluorene-11,9'-fluorene];2-methylspiro[benzo[b]fluorene-11,9'-fluorene];9-methylspiro[benzo[c]fluorene-7,9'-fluorene];(yttrium) (PubChem CID 161073358) has the molecular formula C120H143NY31-2 and a molecular weight of 4355.56 g/mol. Its IUPAC name is ethane;2-methylprop-2-enylideneazanide;9-methylspiro[benzo[a]fluorene-11,9'-fluorene];2-methylspiro[benzo[b]fluorene-11,9'-fluorene];9-methylspiro[benzo[c]fluorene-7,9'-fluorene];(yttrium).

Molecular Properties

• Compound Name: ethane;2-methylprop-2-enylideneazanide;9-methylspiro[benzo[a]fluorene-11,9'-fluorene];2-methylspiro[benzo[b]fluorene-11,9'-fluorene];9-methylspiro[benzo[c]fluorene-7,9'-fluorene];(yttrium)
• PubChem CID: 161073358
• Molecular Formula: C120H143NY31-2
• Molecular Weight: 4355.56 g/mol
• Exact Mass: 4354.20
• IUPAC Name: ethane;2-methylprop-2-enylideneazanide;9-methylspiro[benzo[a]fluorene-11,9'-fluorene];2-methylspiro[benzo[b]fluorene-11,9'-fluorene];9-methylspiro[benzo[c]fluorene-7,9'-fluorene];(yttrium)
• SMILES: CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.Cc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1c-2ccc2ccccc12.Cc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cc3ccccc3cc1-2.Cc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1ccc3ccccc3c1-2.[H]/[C-]=C(\C)C=[N-].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y]
• InChI: InChI=1S/3C30H20.C4H5N.13C2H6.31Y/c1-19-14-16-24-25-17-15-20-8-2-3-9-21(20)29(25)30(28(24)18-19)26-12-6-4-10-22(26)23-11-5-7-13-27(23)30;1-19-14-16-24-28(18-19)30(27-17-15-20-8-2-3-9-21(20)29(24)27)25-12-6-4-10-22(25)23-11-5-7-13-26(23)30;1-19-14-15-24-25-17-20-8-2-3-9-21(20)18-29(25)30(28(24)16-19)26-12-6-4-10-22(26)23-11-5-7-13-27(23)30;1-4(2)3-5;13*1-2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h3*2-18H,1H3;1,3H,2H3;13*1-2H3;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;-2
• InChIKey: DXDMUPKOPOGQII-UHFFFAOYSA-N
• XLogP: 36.74
• TPSA: 22.30 Ų
• Rotatable Bonds: 1
• Heavy Atoms: 152
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	4355.56
LogP ≤ 5	36.74
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of ethane;2-methylprop-2-enylideneazanide;9-methylspiro[benzo[a]fluorene-11,9'-fluorene];2-methylspiro[benzo[b]fluorene-11,9'-fluorene];9-methylspiro[benzo[c]fluorene-7,9'-fluorene];(yttrium)?

The IUPAC name of ethane;2-methylprop-2-enylideneazanide;9-methylspiro[benzo[a]fluorene-11,9'-fluorene];2-methylspiro[benzo[b]fluorene-11,9'-fluorene];9-methylspiro[benzo[c]fluorene-7,9'-fluorene];(yttrium) (CID 161073358) is ethane;2-methylprop-2-enylideneazanide;9-methylspiro[benzo[a]fluorene-11,9'-fluorene];2-methylspiro[benzo[b]fluorene-11,9'-fluorene];9-methylspiro[benzo[c]fluorene-7,9'-fluorene];(yttrium).

What is the SMILES notation for ethane;2-methylprop-2-enylideneazanide;9-methylspiro[benzo[a]fluorene-11,9'-fluorene];2-methylspiro[benzo[b]fluorene-11,9'-fluorene];9-methylspiro[benzo[c]fluorene-7,9'-fluorene];(yttrium)?

The canonical SMILES for ethane;2-methylprop-2-enylideneazanide;9-methylspiro[benzo[a]fluorene-11,9'-fluorene];2-methylspiro[benzo[b]fluorene-11,9'-fluorene];9-methylspiro[benzo[c]fluorene-7,9'-fluorene];(yttrium) is CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.Cc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1c-2ccc2ccccc12.Cc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cc3ccccc3cc1-2.Cc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1ccc3ccccc3c1-2.[H]/[C-]=C(\C)C=[N-].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].

What is the InChIKey of ethane;2-methylprop-2-enylideneazanide;9-methylspiro[benzo[a]fluorene-11,9'-fluorene];2-methylspiro[benzo[b]fluorene-11,9'-fluorene];9-methylspiro[benzo[c]fluorene-7,9'-fluorene];(yttrium)?

The InChIKey is DXDMUPKOPOGQII-UHFFFAOYSA-N. The full InChI is InChI=1S/3C30H20.C4H5N.13C2H6.31Y/c1-19-14-16-24-25-17-15-20-8-2-3-9-21(20)29(25)30(28(24)18-19)26-12-6-4-10-22(26)23-11-5-7-13-27(23)30;1-19-14-16-24-28(18-19)30(27-17-15-20-8-2-3-9-21(20)29(24)27)25-12-6-4-10-22(25)23-11-5-7-13-26(23)30;1-19-14-15-24-25-17-20-8-2-3-9-21(20)18-29(25)30(28(24)16-19)26-12-6-4-10-22(26)23-11-5-7-13-27(23)30;1-4(2)3-5;13*1-2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h3*2-18H,1H3;1,3H,2H3;13*1-2H3;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;-2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;.

What are the key properties of ethane;2-methylprop-2-enylideneazanide;9-methylspiro[benzo[a]fluorene-11,9'-fluorene];2-methylspiro[benzo[b]fluorene-11,9'-fluorene];9-methylspiro[benzo[c]fluorene-7,9'-fluorene];(yttrium)?

ethane;2-methylprop-2-enylideneazanide;9-methylspiro[benzo[a]fluorene-11,9'-fluorene];2-methylspiro[benzo[b]fluorene-11,9'-fluorene];9-methylspiro[benzo[c]fluorene-7,9'-fluorene];(yttrium) has a molecular weight of 4355.56 g/mol, XLogP of 36.74, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for ethane;2-methylprop-2-enylideneazanide;9-methylspiro[benzo[a]fluorene-11,9'-fluorene];2-methylspiro[benzo[b]fluorene-11,9'-fluorene];9-methylspiro[benzo[c]fluorene-7,9'-fluorene];(yttrium) is sourced from PubChem (CID 161073358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).