3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxynaphthalen-1-yl]naphthalen-2-ol;3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydronaphthalen-1-yl]-5,6,7,8-tetrahydronaphthalen-2-ol;3-bromo-1-(3-bromo-2-methoxynaphthalen-1-yl)naphthalen-2-ol;3-bromo-1-(3-bromo-2-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-ol;tris(2,5-dimethylpyrrol-1-ide);tetrakis([2,6-di(propan-2-yl)phenyl]imino-(2-methyl-2-phenylpropylidene)molybdenum);pyrrol-1-ide

C204H240Br8Mo4N8O7Si2-4 — CID 159476015

About 3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxynaphthalen-1-yl]naphthalen-2-ol;3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydronaphthalen-1-yl]-5,6,7,8-tetrahydronaphthalen-2-ol;3-bromo-1-(3-bromo-2-methoxynaphthalen-1-yl)naphthalen-2-ol;3-bromo-1-(3-bromo-2-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-ol;tris(2,5-dimethylpyrrol-1-ide);tetrakis([2,6-di(propan-2-yl)phenyl]imino-(2-methyl-2-phenylpropylidene)molybdenum);pyrrol-1-ide

3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxynaphthalen-1-yl]naphthalen-2-ol;3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydronaphthalen-1-yl]-5,6,7,8-tetrahydronaphthalen-2-ol;3-bromo-1-(3-bromo-2-methoxynaphthalen-1-yl)naphthalen-2-ol;3-bromo-1-(3-bromo-2-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-ol;tris(2,5-dimethylpyrrol-1-ide);tetrakis([2,6-di(propan-2-yl)phenyl]imino-(2-methyl-2-phenylpropylidene)molybdenum);pyrrol-1-ide (PubChem CID 159476015) has the molecular formula C204H240Br8Mo4N8O7Si2-4 and a molecular weight of 3995.38 g/mol. Its IUPAC name is 3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxynaphthalen-1-yl]naphthalen-2-ol;3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydronaphthalen-1-yl]-5,6,7,8-tetrahydronaphthalen-2-ol;3-bromo-1-(3-bromo-2-methoxynaphthalen-1-yl)naphthalen-2-ol;3-bromo-1-(3-bromo-2-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-ol;tris(2,5-dimethylpyrrol-1-ide);tetrakis([2,6-di(propan-2-yl)phenyl]imino-(2-methyl-2-phenylpropylidene)molybdenum);pyrrol-1-ide.

Molecular Properties

• Compound Name: 3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxynaphthalen-1-yl]naphthalen-2-ol;3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydronaphthalen-1-yl]-5,6,7,8-tetrahydronaphthalen-2-ol;3-bromo-1-(3-bromo-2-methoxynaphthalen-1-yl)naphthalen-2-ol;3-bromo-1-(3-bromo-2-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-ol;tris(2,5-dimethylpyrrol-1-ide);tetrakis([2,6-di(propan-2-yl)phenyl]imino-(2-methyl-2-phenylpropylidene)molybdenum);pyrrol-1-ide
• PubChem CID: 159476015
• Molecular Formula: C204H240Br8Mo4N8O7Si2-4
• Molecular Weight: 3995.38 g/mol
• Exact Mass: 3992.79
• IUPAC Name: 3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxynaphthalen-1-yl]naphthalen-2-ol;3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydronaphthalen-1-yl]-5,6,7,8-tetrahydronaphthalen-2-ol;3-bromo-1-(3-bromo-2-methoxynaphthalen-1-yl)naphthalen-2-ol;3-bromo-1-(3-bromo-2-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-ol;tris(2,5-dimethylpyrrol-1-ide);tetrakis([2,6-di(propan-2-yl)phenyl]imino-(2-methyl-2-phenylpropylidene)molybdenum);pyrrol-1-ide
• SMILES: CC(C)(C)[Si](C)(C)Oc1c(Br)cc2c(c1-c1c(O)c(Br)cc3c1CCCC3)CCCC2.CC(C)(C)[Si](C)(C)Oc1c(Br)cc2ccccc2c1-c1c(O)c(Br)cc2ccccc12.CC(C)c1cccc(C(C)C)c1N=[Mo]=CC(C)(C)c1ccccc1.CC(C)c1cccc(C(C)C)c1N=[Mo]=CC(C)(C)c1ccccc1.CC(C)c1cccc(C(C)C)c1N=[Mo]=CC(C)(C)c1ccccc1.CC(C)c1cccc(C(C)C)c1N=[Mo]=CC(C)(C)c1ccccc1.COc1c(Br)cc2ccccc2c1-c1c(O)c(Br)cc2ccccc12.Cc1c(Br)cc2c(c1-c1c(O)c(Br)cc3c1CCCC3)CCCC2.Cc1ccc(C)[n-]1.Cc1ccc(C)[n-]1.Cc1ccc(C)[n-]1.c1cc[n-]c1
• InChI: InChI=1S/C26H34Br2O2Si.C26H26Br2O2Si.C21H14Br2O2.C21H22Br2O.4C12H17N.4C10H12.3C6H8N.C4H4N.4Mo/c2*1-26(2,3)31(4,5)30-25-21(28)15-17-11-7-9-13-19(17)23(25)22-18-12-8-6-10-16(18)14-20(27)24(22)29;1-25-21-17(23)11-13-7-3-5-9-15(13)19(21)18-14-8-4-2-6-12(14)10-16(22)20(18)24;1-12-17(22)10-13-6-2-4-8-15(13)19(12)20-16-9-5-3-7-14(16)11-18(23)21(20)24;4*1-8(2)10-6-5-7-11(9(3)4)12(10)13;4*1-10(2,3)9-7-5-4-6-8-9;3*1-5-3-4-6(2)7-5;1-2-4-5-3-1;;;;/h14-15,29H,6-13H2,1-5H3;6-15,29H,1-5H3;2-11,24H,1H3;10-11,24H,2-9H2,1H3;4*5-9H,1-4H3;4*1,4-8H,2-3H3;3*3-4H,1-2H3;1-4H;;;;/q;;;;;;;;;;;;4*-1
• InChIKey: WJOOTRQNNATMJN-UHFFFAOYSA-N
• XLogP: 62.42
• TPSA: 214.45 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 11
• Rotatable Bonds: 29
• Heavy Atoms: 233
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3995.38
LogP ≤ 5	62.42
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	11

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxynaphthalen-1-yl]naphthalen-2-ol;3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydronaphthalen-1-yl]-5,6,7,8-tetrahydronaphthalen-2-ol;3-bromo-1-(3-bromo-2-methoxynaphthalen-1-yl)naphthalen-2-ol;3-bromo-1-(3-bromo-2-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-ol;tris(2,5-dimethylpyrrol-1-ide);tetrakis([2,6-di(propan-2-yl)phenyl]imino-(2-methyl-2-phenylpropylidene)molybdenum);pyrrol-1-ide?

The IUPAC name of 3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxynaphthalen-1-yl]naphthalen-2-ol;3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydronaphthalen-1-yl]-5,6,7,8-tetrahydronaphthalen-2-ol;3-bromo-1-(3-bromo-2-methoxynaphthalen-1-yl)naphthalen-2-ol;3-bromo-1-(3-bromo-2-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-ol;tris(2,5-dimethylpyrrol-1-ide);tetrakis([2,6-di(propan-2-yl)phenyl]imino-(2-methyl-2-phenylpropylidene)molybdenum);pyrrol-1-ide (CID 159476015) is 3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxynaphthalen-1-yl]naphthalen-2-ol;3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydronaphthalen-1-yl]-5,6,7,8-tetrahydronaphthalen-2-ol;3-bromo-1-(3-bromo-2-methoxynaphthalen-1-yl)naphthalen-2-ol;3-bromo-1-(3-bromo-2-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-ol;tris(2,5-dimethylpyrrol-1-ide);tetrakis([2,6-di(propan-2-yl)phenyl]imino-(2-methyl-2-phenylpropylidene)molybdenum);pyrrol-1-ide.

What is the SMILES notation for 3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxynaphthalen-1-yl]naphthalen-2-ol;3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydronaphthalen-1-yl]-5,6,7,8-tetrahydronaphthalen-2-ol;3-bromo-1-(3-bromo-2-methoxynaphthalen-1-yl)naphthalen-2-ol;3-bromo-1-(3-bromo-2-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-ol;tris(2,5-dimethylpyrrol-1-ide);tetrakis([2,6-di(propan-2-yl)phenyl]imino-(2-methyl-2-phenylpropylidene)molybdenum);pyrrol-1-ide?

The canonical SMILES for 3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxynaphthalen-1-yl]naphthalen-2-ol;3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydronaphthalen-1-yl]-5,6,7,8-tetrahydronaphthalen-2-ol;3-bromo-1-(3-bromo-2-methoxynaphthalen-1-yl)naphthalen-2-ol;3-bromo-1-(3-bromo-2-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-ol;tris(2,5-dimethylpyrrol-1-ide);tetrakis([2,6-di(propan-2-yl)phenyl]imino-(2-methyl-2-phenylpropylidene)molybdenum);pyrrol-1-ide is CC(C)(C)[Si](C)(C)Oc1c(Br)cc2c(c1-c1c(O)c(Br)cc3c1CCCC3)CCCC2.CC(C)(C)[Si](C)(C)Oc1c(Br)cc2ccccc2c1-c1c(O)c(Br)cc2ccccc12.CC(C)c1cccc(C(C)C)c1N=[Mo]=CC(C)(C)c1ccccc1.CC(C)c1cccc(C(C)C)c1N=[Mo]=CC(C)(C)c1ccccc1.CC(C)c1cccc(C(C)C)c1N=[Mo]=CC(C)(C)c1ccccc1.CC(C)c1cccc(C(C)C)c1N=[Mo]=CC(C)(C)c1ccccc1.COc1c(Br)cc2ccccc2c1-c1c(O)c(Br)cc2ccccc12.Cc1c(Br)cc2c(c1-c1c(O)c(Br)cc3c1CCCC3)CCCC2.Cc1ccc(C)[n-]1.Cc1ccc(C)[n-]1.Cc1ccc(C)[n-]1.c1cc[n-]c1.

What is the InChIKey of 3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxynaphthalen-1-yl]naphthalen-2-ol;3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydronaphthalen-1-yl]-5,6,7,8-tetrahydronaphthalen-2-ol;3-bromo-1-(3-bromo-2-methoxynaphthalen-1-yl)naphthalen-2-ol;3-bromo-1-(3-bromo-2-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-ol;tris(2,5-dimethylpyrrol-1-ide);tetrakis([2,6-di(propan-2-yl)phenyl]imino-(2-methyl-2-phenylpropylidene)molybdenum);pyrrol-1-ide?

The InChIKey is WJOOTRQNNATMJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H34Br2O2Si.C26H26Br2O2Si.C21H14Br2O2.C21H22Br2O.4C12H17N.4C10H12.3C6H8N.C4H4N.4Mo/c2*1-26(2,3)31(4,5)30-25-21(28)15-17-11-7-9-13-19(17)23(25)22-18-12-8-6-10-16(18)14-20(27)24(22)29;1-25-21-17(23)11-13-7-3-5-9-15(13)19(21)18-14-8-4-2-6-12(14)10-16(22)20(18)24;1-12-17(22)10-13-6-2-4-8-15(13)19(12)20-16-9-5-3-7-14(16)11-18(23)21(20)24;4*1-8(2)10-6-5-7-11(9(3)4)12(10)13;4*1-10(2,3)9-7-5-4-6-8-9;3*1-5-3-4-6(2)7-5;1-2-4-5-3-1;;;;/h14-15,29H,6-13H2,1-5H3;6-15,29H,1-5H3;2-11,24H,1H3;10-11,24H,2-9H2,1H3;4*5-9H,1-4H3;4*1,4-8H,2-3H3;3*3-4H,1-2H3;1-4H;;;;/q;;;;;;;;;;;;4*-1;;;;.

What are the key properties of 3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxynaphthalen-1-yl]naphthalen-2-ol;3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydronaphthalen-1-yl]-5,6,7,8-tetrahydronaphthalen-2-ol;3-bromo-1-(3-bromo-2-methoxynaphthalen-1-yl)naphthalen-2-ol;3-bromo-1-(3-bromo-2-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-ol;tris(2,5-dimethylpyrrol-1-ide);tetrakis([2,6-di(propan-2-yl)phenyl]imino-(2-methyl-2-phenylpropylidene)molybdenum);pyrrol-1-ide?

3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxynaphthalen-1-yl]naphthalen-2-ol;3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydronaphthalen-1-yl]-5,6,7,8-tetrahydronaphthalen-2-ol;3-bromo-1-(3-bromo-2-methoxynaphthalen-1-yl)naphthalen-2-ol;3-bromo-1-(3-bromo-2-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-ol;tris(2,5-dimethylpyrrol-1-ide);tetrakis([2,6-di(propan-2-yl)phenyl]imino-(2-methyl-2-phenylpropylidene)molybdenum);pyrrol-1-ide has a molecular weight of 3995.38 g/mol, XLogP of 62.42, 29 rotatable bonds, 4 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for 3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxynaphthalen-1-yl]naphthalen-2-ol;3-bromo-1-[3-bromo-2-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydronaphthalen-1-yl]-5,6,7,8-tetrahydronaphthalen-2-ol;3-bromo-1-(3-bromo-2-methoxynaphthalen-1-yl)naphthalen-2-ol;3-bromo-1-(3-bromo-2-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-ol;tris(2,5-dimethylpyrrol-1-ide);tetrakis([2,6-di(propan-2-yl)phenyl]imino-(2-methyl-2-phenylpropylidene)molybdenum);pyrrol-1-ide is sourced from PubChem (CID 159476015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).