2-[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]ethyliminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride

C52H72ClMnN2O16+ — CID 135889343

About 2-[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]ethyliminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride

2-[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]ethyliminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride (PubChem CID 135889343) has the molecular formula C52H72ClMnN2O16+ and a molecular weight of 1071.54 g/mol. Its IUPAC name is 2-[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]ethyliminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride.

Molecular Properties

• Compound Name: 2-[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]ethyliminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride
• PubChem CID: 135889343
• Molecular Formula: C52H72ClMnN2O16+
• Molecular Weight: 1071.54 g/mol
• Exact Mass: 1070.39
• IUPAC Name: 2-[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]ethyliminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride
• SMILES: COCCOCCOCCOCCOCCOc1ccccc1-c1cc(/C=N/CC/N=C/c2cc(-c3ccccc3OCCOCCOCCOCCOCCOC)cc(OC)c2O)c(O)c(OC)c1.[Cl-].[Mn+2]
• InChI: InChI=1S/C52H72N2O16.ClH.Mn/c1-57-15-17-61-19-21-63-23-25-65-27-29-67-31-33-69-47-11-7-5-9-45(47)41-35-43(51(55)49(37-41)59-3)39-53-13-14-54-40-44-36-42(38-50(60-4)52(44)56)46-10-6-8-12-48(46)70-34-32-68-30-28-66-26-24-64-22-20-62-18-16-58-2;;/h5-12,35-40,55-56H,13-34H2,1-4H3;1H;/q;;+2/p-1/b53-39+,54-40+
• InChIKey: QMXCQXRFUOXDRK-BZTXCEGFSA-M
• XLogP: 3.17
• TPSA: 194.40 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 18
• Rotatable Bonds: 41
• Heavy Atoms: 72
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1071.54
LogP ≤ 5	3.17
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	18

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]ethyliminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride?

The IUPAC name of 2-[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]ethyliminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride (CID 135889343) is 2-[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]ethyliminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride.

What is the SMILES notation for 2-[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]ethyliminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride?

The canonical SMILES for 2-[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]ethyliminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride is COCCOCCOCCOCCOCCOc1ccccc1-c1cc(/C=N/CC/N=C/c2cc(-c3ccccc3OCCOCCOCCOCCOCCOC)cc(OC)c2O)c(O)c(OC)c1.[Cl-].[Mn+2].

What is the InChIKey of 2-[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]ethyliminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride?

The InChIKey is QMXCQXRFUOXDRK-BZTXCEGFSA-M. The full InChI is InChI=1S/C52H72N2O16.ClH.Mn/c1-57-15-17-61-19-21-63-23-25-65-27-29-67-31-33-69-47-11-7-5-9-45(47)41-35-43(51(55)49(37-41)59-3)39-53-13-14-54-40-44-36-42(38-50(60-4)52(44)56)46-10-6-8-12-48(46)70-34-32-68-30-28-66-26-24-64-22-20-62-18-16-58-2;;/h5-12,35-40,55-56H,13-34H2,1-4H3;1H;/q;;+2/p-1/b53-39+,54-40+;;.

What are the key properties of 2-[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]ethyliminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride?

2-[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]ethyliminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride has a molecular weight of 1071.54 g/mol, XLogP of 3.17, 41 rotatable bonds, 2 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]ethyliminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride is sourced from PubChem (CID 135889343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).