3,3,24,24-tetramethyl-6,21-dinaphthalen-2-ylhexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18(23),19,21-undecaene

C48H36 — CID 59181698

About 3,3,24,24-tetramethyl-6,21-dinaphthalen-2-ylhexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18(23),19,21-undecaene

3,3,24,24-tetramethyl-6,21-dinaphthalen-2-ylhexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18(23),19,21-undecaene (PubChem CID 59181698) has the molecular formula C48H36 and a molecular weight of 612.82 g/mol. Its IUPAC name is 3,3,24,24-tetramethyl-6,21-dinaphthalen-2-ylhexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18(23),19,21-undecaene.

Molecular Properties

• Compound Name: 3,3,24,24-tetramethyl-6,21-dinaphthalen-2-ylhexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18(23),19,21-undecaene
• PubChem CID: 59181698
• Molecular Formula: C48H36
• Molecular Weight: 612.82 g/mol
• Exact Mass: 612.28
• IUPAC Name: 3,3,24,24-tetramethyl-6,21-dinaphthalen-2-ylhexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18(23),19,21-undecaene
• SMILES: CC1(C)c2cc(-c3ccc4ccccc4c3)ccc2-c2c1c1c(c3ccccc23)-c2ccc(-c3ccc4ccccc4c3)cc2C1(C)C
• InChI: InChI=1S/C48H36/c1-47(2)41-27-35(33-19-17-29-11-5-7-13-31(29)25-33)21-23-39(41)43-37-15-9-10-16-38(37)44-40-24-22-36(28-42(40)48(3,4)46(44)45(43)47)34-20-18-30-12-6-8-14-32(30)26-34/h5-28H,1-4H3
• InChIKey: ULGGFORMRMFZKQ-UHFFFAOYSA-N
• XLogP: 13.09
• TPSA: 0.00 Ų
• Rotatable Bonds: 2
• Heavy Atoms: 48
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	612.82
LogP ≤ 5	13.09
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Frequently Asked Questions

What is the IUPAC name of 3,3,24,24-tetramethyl-6,21-dinaphthalen-2-ylhexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18(23),19,21-undecaene?

The IUPAC name of 3,3,24,24-tetramethyl-6,21-dinaphthalen-2-ylhexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18(23),19,21-undecaene (CID 59181698) is 3,3,24,24-tetramethyl-6,21-dinaphthalen-2-ylhexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18(23),19,21-undecaene.

What is the SMILES notation for 3,3,24,24-tetramethyl-6,21-dinaphthalen-2-ylhexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18(23),19,21-undecaene?

The canonical SMILES for 3,3,24,24-tetramethyl-6,21-dinaphthalen-2-ylhexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18(23),19,21-undecaene is CC1(C)c2cc(-c3ccc4ccccc4c3)ccc2-c2c1c1c(c3ccccc23)-c2ccc(-c3ccc4ccccc4c3)cc2C1(C)C.

What is the InChIKey of 3,3,24,24-tetramethyl-6,21-dinaphthalen-2-ylhexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18(23),19,21-undecaene?

The InChIKey is ULGGFORMRMFZKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H36/c1-47(2)41-27-35(33-19-17-29-11-5-7-13-31(29)25-33)21-23-39(41)43-37-15-9-10-16-38(37)44-40-24-22-36(28-42(40)48(3,4)46(44)45(43)47)34-20-18-30-12-6-8-14-32(30)26-34/h5-28H,1-4H3.

What are the key properties of 3,3,24,24-tetramethyl-6,21-dinaphthalen-2-ylhexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18(23),19,21-undecaene?

3,3,24,24-tetramethyl-6,21-dinaphthalen-2-ylhexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18(23),19,21-undecaene has a molecular weight of 612.82 g/mol, XLogP of 13.09, 2 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-6,21-dinaphthalen-2-ylhexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18(23),19,21-undecaene is sourced from PubChem (CID 59181698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).