2-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(12,12-dimethyl-9-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaenyl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethyl-9-phenylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol

C170H186N12O8 — CID 165033063

About 2-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(12,12-dimethyl-9-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaenyl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethyl-9-phenylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol

2-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(12,12-dimethyl-9-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaenyl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethyl-9-phenylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol (PubChem CID 165033063) has the molecular formula C170H186N12O8 and a molecular weight of 2525.43 g/mol. Its IUPAC name is 2-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(12,12-dimethyl-9-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaenyl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethyl-9-phenylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol.

Molecular Properties

• Compound Name: 2-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(12,12-dimethyl-9-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaenyl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethyl-9-phenylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol
• PubChem CID: 165033063
• Molecular Formula: C170H186N12O8
• Molecular Weight: 2525.43 g/mol
• Exact Mass: 2523.45
• IUPAC Name: 2-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(12,12-dimethyl-9-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaenyl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethyl-9-phenylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol
• SMILES: CCCCCCCCCCCCOc1nc(-c2ccc3c(c2)C(C)(C)c2cc4ccccc4cc2-3)nc(-c2ccccc2O)n1.CCCCCCCCCCCCOc1nc(-c2ccccc2O)nc(-c2cc3c(c4ccccc24)-c2c(ccc4ccccc24)C3(C)C)n1.CCCCCCCCCCCCOc1nc(-c2ccccc2O)nc(-c2cc3c(c4ccccc24)-c2ccc(-c4ccccc4)cc2C3(C)C)n1.CCCCCCCCCCCCOc1nc(-c2ccccc2O)nc(-c2cc3c(c4ccccc24)-c2ccccc2C3(C)C)n1
• InChI: InChI=1S/C46H49N3O2.C44H47N3O2.2C40H45N3O2/c1-4-5-6-7-8-9-10-11-12-20-29-51-45-48-43(37-25-18-19-26-41(37)50)47-44(49-45)38-31-40-42(35-24-17-16-23-34(35)38)36-28-27-33(30-39(36)46(40,2)3)32-21-14-13-15-22-32;1-4-5-6-7-8-9-10-11-12-19-28-49-43-46-41(34-24-17-18-25-38(34)48)45-42(47-43)35-29-37-40(33-23-16-15-22-32(33)35)39-31-21-14-13-20-30(31)26-27-36(39)44(37,2)3;1-4-5-6-7-8-9-10-11-12-19-26-45-39-42-37(31-23-16-18-25-35(31)44)41-38(43-39)32-27-34-36(29-21-14-13-20-28(29)32)30-22-15-17-24-33(30)40(34,2)3;1-4-5-6-7-8-9-10-11-12-17-24-45-39-42-37(41-38(43-39)32-20-15-16-21-36(32)44)30-22-23-31-33-25-28-18-13-14-19-29(28)26-35(33)40(2,3)34(31)27-30/h13-19,21-28,30-31,50H,4-12,20,29H2,1-3H3;13-18,20-27,29,48H,4-12,19,28H2,1-3H3;13-18,20-25,27,44H,4-12,19,26H2,1-3H3;13-16,18-23,25-27,44H,4-12,17,24H2,1-3H3
• InChIKey: MYQFBQNMVSDKEG-UHFFFAOYSA-N
• XLogP: 45.50
• TPSA: 272.52 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 20
• Rotatable Bonds: 57
• Heavy Atoms: 190
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2525.43
LogP ≤ 5	45.50
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(12,12-dimethyl-9-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaenyl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethyl-9-phenylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol?

The IUPAC name of 2-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(12,12-dimethyl-9-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaenyl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethyl-9-phenylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol (CID 165033063) is 2-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(12,12-dimethyl-9-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaenyl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethyl-9-phenylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol.

What is the SMILES notation for 2-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(12,12-dimethyl-9-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaenyl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethyl-9-phenylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol?

The canonical SMILES for 2-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(12,12-dimethyl-9-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaenyl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethyl-9-phenylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol is CCCCCCCCCCCCOc1nc(-c2ccc3c(c2)C(C)(C)c2cc4ccccc4cc2-3)nc(-c2ccccc2O)n1.CCCCCCCCCCCCOc1nc(-c2ccccc2O)nc(-c2cc3c(c4ccccc24)-c2c(ccc4ccccc24)C3(C)C)n1.CCCCCCCCCCCCOc1nc(-c2ccccc2O)nc(-c2cc3c(c4ccccc24)-c2ccc(-c4ccccc4)cc2C3(C)C)n1.CCCCCCCCCCCCOc1nc(-c2ccccc2O)nc(-c2cc3c(c4ccccc24)-c2ccccc2C3(C)C)n1.

What is the InChIKey of 2-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(12,12-dimethyl-9-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaenyl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethyl-9-phenylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol?

The InChIKey is MYQFBQNMVSDKEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H49N3O2.C44H47N3O2.2C40H45N3O2/c1-4-5-6-7-8-9-10-11-12-20-29-51-45-48-43(37-25-18-19-26-41(37)50)47-44(49-45)38-31-40-42(35-24-17-16-23-34(35)38)36-28-27-33(30-39(36)46(40,2)3)32-21-14-13-15-22-32;1-4-5-6-7-8-9-10-11-12-19-28-49-43-46-41(34-24-17-18-25-38(34)48)45-42(47-43)35-29-37-40(33-23-16-15-22-32(33)35)39-31-21-14-13-20-30(31)26-27-36(39)44(37,2)3;1-4-5-6-7-8-9-10-11-12-19-26-45-39-42-37(31-23-16-18-25-35(31)44)41-38(43-39)32-27-34-36(29-21-14-13-20-28(29)32)30-22-15-17-24-33(30)40(34,2)3;1-4-5-6-7-8-9-10-11-12-17-24-45-39-42-37(41-38(43-39)32-20-15-16-21-36(32)44)30-22-23-31-33-25-28-18-13-14-19-29(28)26-35(33)40(2,3)34(31)27-30/h13-19,21-28,30-31,50H,4-12,20,29H2,1-3H3;13-18,20-27,29,48H,4-12,19,28H2,1-3H3;13-18,20-25,27,44H,4-12,19,26H2,1-3H3;13-16,18-23,25-27,44H,4-12,17,24H2,1-3H3.

What are the key properties of 2-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(12,12-dimethyl-9-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaenyl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethyl-9-phenylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol?

2-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(12,12-dimethyl-9-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaenyl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethyl-9-phenylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol has a molecular weight of 2525.43 g/mol, XLogP of 45.50, 57 rotatable bonds, 4 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(12,12-dimethyl-9-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaenyl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol;2-[4-(7,7-dimethyl-9-phenylbenzo[c]fluoren-5-yl)-6-dodecoxy-1,3,5-triazin-2-yl]phenol is sourced from PubChem (CID 165033063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).