3,3,24,24-tetramethyl-7-naphthalen-2-yl-3,24-disilahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18,20,22-undecaene

C36H30Si2 — CID 171742945

About 3,3,24,24-tetramethyl-7-naphthalen-2-yl-3,24-disilahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18,20,22-undecaene

3,3,24,24-tetramethyl-7-naphthalen-2-yl-3,24-disilahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18,20,22-undecaene (PubChem CID 171742945) has the molecular formula C36H30Si2 and a molecular weight of 518.81 g/mol. Its IUPAC name is 3,3,24,24-tetramethyl-7-naphthalen-2-yl-3,24-disilahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18,20,22-undecaene.

Molecular Properties

• Compound Name: 3,3,24,24-tetramethyl-7-naphthalen-2-yl-3,24-disilahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18,20,22-undecaene
• PubChem CID: 171742945
• Molecular Formula: C36H30Si2
• Molecular Weight: 518.81 g/mol
• Exact Mass: 518.19
• IUPAC Name: 3,3,24,24-tetramethyl-7-naphthalen-2-yl-3,24-disilahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18,20,22-undecaene
• SMILES: C[Si]1(C)c2ccccc2-c2c1c1c(c3ccccc23)-c2cc(-c3ccc4ccccc4c3)ccc2[Si]1(C)C
• InChI: InChI=1S/C36H30Si2/c1-37(2)31-16-10-9-15-29(31)33-27-13-7-8-14-28(27)34-30-22-26(19-20-32(30)38(3,4)36(34)35(33)37)25-18-17-23-11-5-6-12-24(23)21-25/h5-22H,1-4H3
• InChIKey: XGSGUMJDGXEPOM-UHFFFAOYSA-N
• XLogP: 7.27
• TPSA: 0.00 Ų
• Rotatable Bonds: 1
• Heavy Atoms: 38
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	518.81
LogP ≤ 5	7.27
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3,3,24,24-tetramethyl-7-naphthalen-2-yl-3,24-disilahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18,20,22-undecaene?

The IUPAC name of 3,3,24,24-tetramethyl-7-naphthalen-2-yl-3,24-disilahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18,20,22-undecaene (CID 171742945) is 3,3,24,24-tetramethyl-7-naphthalen-2-yl-3,24-disilahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18,20,22-undecaene.

What is the SMILES notation for 3,3,24,24-tetramethyl-7-naphthalen-2-yl-3,24-disilahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18,20,22-undecaene?

The canonical SMILES for 3,3,24,24-tetramethyl-7-naphthalen-2-yl-3,24-disilahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18,20,22-undecaene is C[Si]1(C)c2ccccc2-c2c1c1c(c3ccccc23)-c2cc(-c3ccc4ccccc4c3)ccc2[Si]1(C)C.

What is the InChIKey of 3,3,24,24-tetramethyl-7-naphthalen-2-yl-3,24-disilahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18,20,22-undecaene?

The InChIKey is XGSGUMJDGXEPOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H30Si2/c1-37(2)31-16-10-9-15-29(31)33-27-13-7-8-14-28(27)34-30-22-26(19-20-32(30)38(3,4)36(34)35(33)37)25-18-17-23-11-5-6-12-24(23)21-25/h5-22H,1-4H3.

What are the key properties of 3,3,24,24-tetramethyl-7-naphthalen-2-yl-3,24-disilahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18,20,22-undecaene?

3,3,24,24-tetramethyl-7-naphthalen-2-yl-3,24-disilahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18,20,22-undecaene has a molecular weight of 518.81 g/mol, XLogP of 7.27, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for 3,3,24,24-tetramethyl-7-naphthalen-2-yl-3,24-disilahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18,20,22-undecaene is sourced from PubChem (CID 171742945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).