10H-benzo[h]quinolin-10-ide;dysprosium;europium;bis(4-hydroxypent-3-en-2-one);bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;2-(2H-naphthalen-2-id-1-yl)pyridine;bis(1,10-phenanthroline);terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one

C99H74DyEuF6Ir2N7O8STb-3 — CID 158313255

About 10H-benzo[h]quinolin-10-ide;dysprosium;europium;bis(4-hydroxypent-3-en-2-one);bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;2-(2H-naphthalen-2-id-1-yl)pyridine;bis(1,10-phenanthroline);terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one

10H-benzo[h]quinolin-10-ide;dysprosium;europium;bis(4-hydroxypent-3-en-2-one);bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;2-(2H-naphthalen-2-id-1-yl)pyridine;bis(1,10-phenanthroline);terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one (PubChem CID 158313255) has the molecular formula C99H74DyEuF6Ir2N7O8STb-3 and a molecular weight of 2493.60 g/mol. Its IUPAC name is 10H-benzo[h]quinolin-10-ide;dysprosium;europium;bis(4-hydroxypent-3-en-2-one);bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;2-(2H-naphthalen-2-id-1-yl)pyridine;bis(1,10-phenanthroline);terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one.

Molecular Properties

• Compound Name: 10H-benzo[h]quinolin-10-ide;dysprosium;europium;bis(4-hydroxypent-3-en-2-one);bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;2-(2H-naphthalen-2-id-1-yl)pyridine;bis(1,10-phenanthroline);terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one
• PubChem CID: 158313255
• Molecular Formula: C99H74DyEuF6Ir2N7O8STb-3
• Molecular Weight: 2493.60 g/mol
• Exact Mass: 2496.23
• IUPAC Name: 10H-benzo[h]quinolin-10-ide;dysprosium;europium;bis(4-hydroxypent-3-en-2-one);bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;2-(2H-naphthalen-2-id-1-yl)pyridine;bis(1,10-phenanthroline);terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one
• SMILES: CC(=O)C=C(C)O.CC(=O)C=C(C)O.O=C(C=C(O)c1ccccc1)C(F)(F)F.O=C(C=C(O)c1cccs1)C(F)(F)F.[Dy].[Eu].[Ir].[Ir].[Tb].[c-]1cc2ccccc2cc1-c1nccc2ccccc12.[c-]1ccc2ccccc2c1-c1ccccn1.[c-]1cccc2ccc3cccnc3c12.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12
• InChI: InChI=1S/C19H12N.C15H10N.C13H8N.2C12H8N2.C10H7F3O2.C8H5F3O2S.2C5H8O2.Dy.Eu.2Ir.Tb/c1-2-7-16-13-17(10-9-14(16)5-1)19-18-8-4-3-6-15(18)11-12-20-19;1-2-8-13-12(6-1)7-5-9-14(13)15-10-3-4-11-16-15;1-2-6-12-10(4-1)7-8-11-5-3-9-14-13(11)12;2*1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;11-10(12,13)9(15)6-8(14)7-4-2-1-3-5-7;9-8(10,11)7(13)4-5(12)6-2-1-3-14-6;2*1-4(6)3-5(2)7;;;;;/h1-9,11-13H;1-8,10-11H;1-5,7-9H;2*1-8H;1-6,14H;1-4,12H;2*3,6H,1-2H3;;;;;/q3*-1
• InChIKey: KFHZDWGZVFOJJZ-UHFFFAOYSA-N
• XLogP: 24.88
• TPSA: 239.43 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 16
• Rotatable Bonds: 8
• Heavy Atoms: 126
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2493.60
LogP ≤ 5	24.88
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 10H-benzo[h]quinolin-10-ide;dysprosium;europium;bis(4-hydroxypent-3-en-2-one);bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;2-(2H-naphthalen-2-id-1-yl)pyridine;bis(1,10-phenanthroline);terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one?

The IUPAC name of 10H-benzo[h]quinolin-10-ide;dysprosium;europium;bis(4-hydroxypent-3-en-2-one);bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;2-(2H-naphthalen-2-id-1-yl)pyridine;bis(1,10-phenanthroline);terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one (CID 158313255) is 10H-benzo[h]quinolin-10-ide;dysprosium;europium;bis(4-hydroxypent-3-en-2-one);bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;2-(2H-naphthalen-2-id-1-yl)pyridine;bis(1,10-phenanthroline);terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one.

What is the SMILES notation for 10H-benzo[h]quinolin-10-ide;dysprosium;europium;bis(4-hydroxypent-3-en-2-one);bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;2-(2H-naphthalen-2-id-1-yl)pyridine;bis(1,10-phenanthroline);terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one?

The canonical SMILES for 10H-benzo[h]quinolin-10-ide;dysprosium;europium;bis(4-hydroxypent-3-en-2-one);bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;2-(2H-naphthalen-2-id-1-yl)pyridine;bis(1,10-phenanthroline);terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one is CC(=O)C=C(C)O.CC(=O)C=C(C)O.O=C(C=C(O)c1ccccc1)C(F)(F)F.O=C(C=C(O)c1cccs1)C(F)(F)F.[Dy].[Eu].[Ir].[Ir].[Tb].[c-]1cc2ccccc2cc1-c1nccc2ccccc12.[c-]1ccc2ccccc2c1-c1ccccn1.[c-]1cccc2ccc3cccnc3c12.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12.

What is the InChIKey of 10H-benzo[h]quinolin-10-ide;dysprosium;europium;bis(4-hydroxypent-3-en-2-one);bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;2-(2H-naphthalen-2-id-1-yl)pyridine;bis(1,10-phenanthroline);terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one?

The InChIKey is KFHZDWGZVFOJJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12N.C15H10N.C13H8N.2C12H8N2.C10H7F3O2.C8H5F3O2S.2C5H8O2.Dy.Eu.2Ir.Tb/c1-2-7-16-13-17(10-9-14(16)5-1)19-18-8-4-3-6-15(18)11-12-20-19;1-2-8-13-12(6-1)7-5-9-14(13)15-10-3-4-11-16-15;1-2-6-12-10(4-1)7-8-11-5-3-9-14-13(11)12;2*1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;11-10(12,13)9(15)6-8(14)7-4-2-1-3-5-7;9-8(10,11)7(13)4-5(12)6-2-1-3-14-6;2*1-4(6)3-5(2)7;;;;;/h1-9,11-13H;1-8,10-11H;1-5,7-9H;2*1-8H;1-6,14H;1-4,12H;2*3,6H,1-2H3;;;;;/q3*-1;;;;;;;;;;;.

What are the key properties of 10H-benzo[h]quinolin-10-ide;dysprosium;europium;bis(4-hydroxypent-3-en-2-one);bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;2-(2H-naphthalen-2-id-1-yl)pyridine;bis(1,10-phenanthroline);terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one?

10H-benzo[h]quinolin-10-ide;dysprosium;europium;bis(4-hydroxypent-3-en-2-one);bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;2-(2H-naphthalen-2-id-1-yl)pyridine;bis(1,10-phenanthroline);terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one has a molecular weight of 2493.60 g/mol, XLogP of 24.88, 8 rotatable bonds, 4 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 10H-benzo[h]quinolin-10-ide;dysprosium;europium;bis(4-hydroxypent-3-en-2-one);bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;2-(2H-naphthalen-2-id-1-yl)pyridine;bis(1,10-phenanthroline);terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one is sourced from PubChem (CID 158313255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).