bromobenzene;3-bromo-11,11-dimethylbenzo[b]fluorene;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenylbenzo[b]fluoren-3-amine;methane;1-naphthalen-1-ylnaphthalen-2-amine;tritiomethane;bis(tritium monohydride)

C131H109Br2N3 — CID 165003325

About bromobenzene;3-bromo-11,11-dimethylbenzo[b]fluorene;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenylbenzo[b]fluoren-3-amine;methane;1-naphthalen-1-ylnaphthalen-2-amine;tritiomethane;bis(tritium monohydride)

bromobenzene;3-bromo-11,11-dimethylbenzo[b]fluorene;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenylbenzo[b]fluoren-3-amine;methane;1-naphthalen-1-ylnaphthalen-2-amine;tritiomethane;bis(tritium monohydride) (PubChem CID 165003325) has the molecular formula C131H109Br2N3 and a molecular weight of 1891.17 g/mol. Its IUPAC name is bromobenzene;3-bromo-11,11-dimethylbenzo[b]fluorene;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenylbenzo[b]fluoren-3-amine;methane;1-naphthalen-1-ylnaphthalen-2-amine;tritiomethane;bis(tritium monohydride).

Molecular Properties

• Compound Name: bromobenzene;3-bromo-11,11-dimethylbenzo[b]fluorene;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenylbenzo[b]fluoren-3-amine;methane;1-naphthalen-1-ylnaphthalen-2-amine;tritiomethane;bis(tritium monohydride)
• PubChem CID: 165003325
• Molecular Formula: C131H109Br2N3
• Molecular Weight: 1891.17 g/mol
• Exact Mass: 1887.72
• IUPAC Name: bromobenzene;3-bromo-11,11-dimethylbenzo[b]fluorene;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenylbenzo[b]fluoren-3-amine;methane;1-naphthalen-1-ylnaphthalen-2-amine;tritiomethane;bis(tritium monohydride)
• SMILES: Brc1ccccc1.C.CC1(C)c2ccc(Br)cc2-c2cc3ccccc3cc21.CC1(C)c2ccc(N(c3ccccc3)c3ccc4ccccc4c3-c3cccc4ccccc34)cc2-c2cc3ccccc3cc21.CC1(C)c2ccc(Nc3ccc4ccccc4c3-c3cccc4ccccc34)cc2-c2cc3ccccc3cc21.Nc1ccc2ccccc2c1-c1cccc2ccccc12.[3H]C.[H][3H].[H][3H]
• InChI: InChI=1S/C45H33N.C39H29N.C20H15N.C19H15Br.C6H5Br.2CH4.2H2/c1-45(2)41-25-24-35(29-40(41)39-27-32-15-6-7-16-33(32)28-42(39)45)46(34-18-4-3-5-19-34)43-26-23-31-14-9-11-21-37(31)44(43)38-22-12-17-30-13-8-10-20-36(30)38;1-39(2)35-20-19-29(24-34(35)33-22-27-12-3-4-13-28(27)23-36(33)39)40-37-21-18-26-11-6-8-16-31(26)38(37)32-17-9-14-25-10-5-7-15-30(25)32;21-19-13-12-15-7-2-4-10-17(15)20(19)18-11-5-8-14-6-1-3-9-16(14)18;1-19(2)17-8-7-14(20)11-16(17)15-9-12-5-3-4-6-13(12)10-18(15)19;7-6-4-2-1-3-5-6;;;;/h3-29H,1-2H3;3-24,40H,1-2H3;1-13H,21H2;3-11H,1-2H3;1-5H;2*1H4;2*1H/i;;;;;1T;;2*1+2
• InChIKey: IOWDQYZPZTYKLX-QIVIKLEESA-N
• XLogP: 38.82
• TPSA: 41.29 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 3
• Rotatable Bonds: 8
• Heavy Atoms: 136
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1891.17
LogP ≤ 5	38.82
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of bromobenzene;3-bromo-11,11-dimethylbenzo[b]fluorene;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenylbenzo[b]fluoren-3-amine;methane;1-naphthalen-1-ylnaphthalen-2-amine;tritiomethane;bis(tritium monohydride)?

The IUPAC name of bromobenzene;3-bromo-11,11-dimethylbenzo[b]fluorene;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenylbenzo[b]fluoren-3-amine;methane;1-naphthalen-1-ylnaphthalen-2-amine;tritiomethane;bis(tritium monohydride) (CID 165003325) is bromobenzene;3-bromo-11,11-dimethylbenzo[b]fluorene;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenylbenzo[b]fluoren-3-amine;methane;1-naphthalen-1-ylnaphthalen-2-amine;tritiomethane;bis(tritium monohydride).

What is the SMILES notation for bromobenzene;3-bromo-11,11-dimethylbenzo[b]fluorene;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenylbenzo[b]fluoren-3-amine;methane;1-naphthalen-1-ylnaphthalen-2-amine;tritiomethane;bis(tritium monohydride)?

The canonical SMILES for bromobenzene;3-bromo-11,11-dimethylbenzo[b]fluorene;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenylbenzo[b]fluoren-3-amine;methane;1-naphthalen-1-ylnaphthalen-2-amine;tritiomethane;bis(tritium monohydride) is Brc1ccccc1.C.CC1(C)c2ccc(Br)cc2-c2cc3ccccc3cc21.CC1(C)c2ccc(N(c3ccccc3)c3ccc4ccccc4c3-c3cccc4ccccc34)cc2-c2cc3ccccc3cc21.CC1(C)c2ccc(Nc3ccc4ccccc4c3-c3cccc4ccccc34)cc2-c2cc3ccccc3cc21.Nc1ccc2ccccc2c1-c1cccc2ccccc12.[3H]C.[H][3H].[H][3H].

What is the InChIKey of bromobenzene;3-bromo-11,11-dimethylbenzo[b]fluorene;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenylbenzo[b]fluoren-3-amine;methane;1-naphthalen-1-ylnaphthalen-2-amine;tritiomethane;bis(tritium monohydride)?

The InChIKey is IOWDQYZPZTYKLX-QIVIKLEESA-N. The full InChI is InChI=1S/C45H33N.C39H29N.C20H15N.C19H15Br.C6H5Br.2CH4.2H2/c1-45(2)41-25-24-35(29-40(41)39-27-32-15-6-7-16-33(32)28-42(39)45)46(34-18-4-3-5-19-34)43-26-23-31-14-9-11-21-37(31)44(43)38-22-12-17-30-13-8-10-20-36(30)38;1-39(2)35-20-19-29(24-34(35)33-22-27-12-3-4-13-28(27)23-36(33)39)40-37-21-18-26-11-6-8-16-31(26)38(37)32-17-9-14-25-10-5-7-15-30(25)32;21-19-13-12-15-7-2-4-10-17(15)20(19)18-11-5-8-14-6-1-3-9-16(14)18;1-19(2)17-8-7-14(20)11-16(17)15-9-12-5-3-4-6-13(12)10-18(15)19;7-6-4-2-1-3-5-6;;;;/h3-29H,1-2H3;3-24,40H,1-2H3;1-13H,21H2;3-11H,1-2H3;1-5H;2*1H4;2*1H/i;;;;;1T;;2*1+2.

What are the key properties of bromobenzene;3-bromo-11,11-dimethylbenzo[b]fluorene;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenylbenzo[b]fluoren-3-amine;methane;1-naphthalen-1-ylnaphthalen-2-amine;tritiomethane;bis(tritium monohydride)?

bromobenzene;3-bromo-11,11-dimethylbenzo[b]fluorene;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenylbenzo[b]fluoren-3-amine;methane;1-naphthalen-1-ylnaphthalen-2-amine;tritiomethane;bis(tritium monohydride) has a molecular weight of 1891.17 g/mol, XLogP of 38.82, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for bromobenzene;3-bromo-11,11-dimethylbenzo[b]fluorene;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenylbenzo[b]fluoren-3-amine;methane;1-naphthalen-1-ylnaphthalen-2-amine;tritiomethane;bis(tritium monohydride) is sourced from PubChem (CID 165003325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).