7-trimethoxysilyl-4,4-bis(3-trimethoxysilylpropyl)heptan-2-one;9-trimethoxysilyl-6,6-bis(3-trimethoxysilylpropyl)nonan-2-one;N-[5-trimethoxysilyl-2,2-bis(3-trimethoxysilylpropyl)pentyl]acetamide;5-(3-trimethoxysilylpropoxy)-4,4-bis(3-trimethoxysilylpropoxymethyl)pentan-2-one;N-[3-(3-trimethoxysilylpropoxy)-2,2-bis(3-trimethoxysilylpropoxymethyl)propyl]acetamide;7-trimethoxysilyl-4-(2-trimethoxysilylethyl)-4-(3-trimethoxysilylpropyl)heptan-2-one;tungsten

C139H310N2O66Si18W6-6 — CID 159266725

IUPAC7-trimethoxysilyl-4,4-bis(3-trimethoxysilylpropyl)heptan-2-one;9-trimethoxysilyl-6,6-bis(3-trimethoxysilylpropyl)nonan-2-one;N-[5-trimethoxysilyl-2,2-bis(3-trimethoxysilylpropyl)pentyl]acetamide;5-(3-trimethoxysilylpropoxy)-4,4-bis(3-trimethoxysilylpropoxymethyl)pentan-2-one;N-[3-(3-trimethoxysilylpropoxy)-2,2-bis(3-trimethoxysilylpropoxymethyl)propyl]acetamide;7-trimethoxysilyl-4-(2-trimethoxysilylethyl)-4-(3-trimethoxysilylpropyl)heptan-2-one;tungsten
SMILES[CH2-]C(=O)CC(CCC[Si](OC)(OC)OC)(CCC[Si](OC)(OC)OC)CCC[Si](OC)(OC)OC.[CH2-]C(=O)CC(CCC[Si](OC)(OC)OC)(CCC[Si](OC)(OC)OC)CC[Si](OC)(OC)OC.[CH2-]C(=O)CC(COCCC[Si](OC)(OC)OC)(COCCC[Si](OC)(OC)OC)COCCC[Si](OC)(OC)OC.[CH2-]C(=O)CCCC(CCC[Si](OC)(OC)OC)(CCC[Si](OC)(OC)OC)CCC[Si](OC)(OC)OC.[CH2-]C(=O)NCC(CCC[Si](OC)(OC)OC)(CCC[Si](OC)(OC)OC)CCC[Si](OC)(OC)OC.[CH2-]C(=O)NCC(COCCC[Si](OC)(OC)OC)(COCCC[Si](OC)(OC)OC)COCCC[Si](OC)(OC)OC.[W].[W].[W].[W].[W].[W]
InChIInChI=1S/C25H56NO13Si3.C25H55O13Si3.C24H53O10Si3.C22H50NO10Si3.C22H49O10Si3.C21H47O10Si3.6W/c1-24(27)26-20-25(21-37-14-11-17-40(28-2,29-3)30-4,22-38-15-12-18-41(31-5,32-6)33-7)23-39-16-13-19-42(34-8,35-9)36-10;1-24(26)20-25(21-36-14-11-17-39(27-2,28-3)29-4,22-37-15-12-18-40(30-5,31-6)32-7)23-38-16-13-19-41(33-8,34-9)35-10;1-23(25)15-11-16-24(17-12-20-35(26-2,27-3)28-4,18-13-21-36(29-5,30-6)31-7)19-14-22-37(32-8,33-9)34-10;1-21(24)23-20-22(14-11-17-34(25-2,26-3)27-4,15-12-18-35(28-5,29-6)30-7)16-13-19-36(31-8,32-9)33-10;1-21(23)20-22(14-11-17-33(24-2,25-3)26-4,15-12-18-34(27-5,28-6)29-7)16-13-19-35(30-8,31-9)32-10;1-20(22)19-21(15-18-34(29-8,30-9)31-10,13-11-16-32(23-2,24-3)25-4)14-12-17-33(26-5,27-6)28-7;;;;;;/h1,11-23H2,2-10H3,(H,26,27);1,11-23H2,2-10H3;1,11-22H2,2-10H3;1,11-20H2,2-10H3,(H,23,24);1,11-20H2,2-10H3;1,11-19H2,2-10H3;;;;;;/q6*-1;;;;;;
InChIKeyILNGWFDAFQHGLY-UHFFFAOYSA-N
MW4674.55 g/mol
LogP18.89
Rot. Bonds151

About 7-trimethoxysilyl-4,4-bis(3-trimethoxysilylpropyl)heptan-2-one;9-trimethoxysilyl-6,6-bis(3-trimethoxysilylpropyl)nonan-2-one;N-[5-trimethoxysilyl-2,2-bis(3-trimethoxysilylpropyl)pentyl]acetamide;5-(3-trimethoxysilylpropoxy)-4,4-bis(3-trimethoxysilylpropoxymethyl)pentan-2-one;N-[3-(3-trimethoxysilylpropoxy)-2,2-bis(3-trimethoxysilylpropoxymethyl)propyl]acetamide;7-trimethoxysilyl-4-(2-trimethoxysilylethyl)-4-(3-trimethoxysilylpropyl)heptan-2-one;tungsten

7-trimethoxysilyl-4,4-bis(3-trimethoxysilylpropyl)heptan-2-one;9-trimethoxysilyl-6,6-bis(3-trimethoxysilylpropyl)nonan-2-one;N-[5-trimethoxysilyl-2,2-bis(3-trimethoxysilylpropyl)pentyl]acetamide;5-(3-trimethoxysilylpropoxy)-4,4-bis(3-trimethoxysilylpropoxymethyl)pentan-2-one;N-[3-(3-trimethoxysilylpropoxy)-2,2-bis(3-trimethoxysilylpropoxymethyl)propyl]acetamide;7-trimethoxysilyl-4-(2-trimethoxysilylethyl)-4-(3-trimethoxysilylpropyl)heptan-2-one;tungsten (PubChem CID 159266725) has the molecular formula C139H310N2O66Si18W6-6 and a molecular weight of 4674.55 g/mol. Its IUPAC name is 7-trimethoxysilyl-4,4-bis(3-trimethoxysilylpropyl)heptan-2-one;9-trimethoxysilyl-6,6-bis(3-trimethoxysilylpropyl)nonan-2-one;N-[5-trimethoxysilyl-2,2-bis(3-trimethoxysilylpropyl)pentyl]acetamide;5-(3-trimethoxysilylpropoxy)-4,4-bis(3-trimethoxysilylpropoxymethyl)pentan-2-one;N-[3-(3-trimethoxysilylpropoxy)-2,2-bis(3-trimethoxysilylpropoxymethyl)propyl]acetamide;7-trimethoxysilyl-4-(2-trimethoxysilylethyl)-4-(3-trimethoxysilylpropyl)heptan-2-one;tungsten.

Molecular Properties

Compound Name7-trimethoxysilyl-4,4-bis(3-trimethoxysilylpropyl)heptan-2-one;9-trimethoxysilyl-6,6-bis(3-trimethoxysilylpropyl)nonan-2-one;N-[5-trimethoxysilyl-2,2-bis(3-trimethoxysilylpropyl)pentyl]acetamide;5-(3-trimethoxysilylpropoxy)-4,4-bis(3-trimethoxysilylpropoxymethyl)pentan-2-one;N-[3-(3-trimethoxysilylpropoxy)-2,2-bis(3-trimethoxysilylpropoxymethyl)propyl]acetamide;7-trimethoxysilyl-4-(2-trimethoxysilylethyl)-4-(3-trimethoxysilylpropyl)heptan-2-one;tungsten
PubChem CID159266725
Molecular FormulaC139H310N2O66Si18W6-6
Molecular Weight4674.55 g/mol
Exact Mass4671.39
IUPAC Name7-trimethoxysilyl-4,4-bis(3-trimethoxysilylpropyl)heptan-2-one;9-trimethoxysilyl-6,6-bis(3-trimethoxysilylpropyl)nonan-2-one;N-[5-trimethoxysilyl-2,2-bis(3-trimethoxysilylpropyl)pentyl]acetamide;5-(3-trimethoxysilylpropoxy)-4,4-bis(3-trimethoxysilylpropoxymethyl)pentan-2-one;N-[3-(3-trimethoxysilylpropoxy)-2,2-bis(3-trimethoxysilylpropoxymethyl)propyl]acetamide;7-trimethoxysilyl-4-(2-trimethoxysilylethyl)-4-(3-trimethoxysilylpropyl)heptan-2-one;tungsten
SMILES[CH2-]C(=O)CC(CCC[Si](OC)(OC)OC)(CCC[Si](OC)(OC)OC)CCC[Si](OC)(OC)OC.[CH2-]C(=O)CC(CCC[Si](OC)(OC)OC)(CCC[Si](OC)(OC)OC)CC[Si](OC)(OC)OC.[CH2-]C(=O)CC(COCCC[Si](OC)(OC)OC)(COCCC[Si](OC)(OC)OC)COCCC[Si](OC)(OC)OC.[CH2-]C(=O)CCCC(CCC[Si](OC)(OC)OC)(CCC[Si](OC)(OC)OC)CCC[Si](OC)(OC)OC.[CH2-]C(=O)NCC(CCC[Si](OC)(OC)OC)(CCC[Si](OC)(OC)OC)CCC[Si](OC)(OC)OC.[CH2-]C(=O)NCC(COCCC[Si](OC)(OC)OC)(COCCC[Si](OC)(OC)OC)COCCC[Si](OC)(OC)OC.[W].[W].[W].[W].[W].[W]
InChIInChI=1S/C25H56NO13Si3.C25H55O13Si3.C24H53O10Si3.C22H50NO10Si3.C22H49O10Si3.C21H47O10Si3.6W/c1-24(27)26-20-25(21-37-14-11-17-40(28-2,29-3)30-4,22-38-15-12-18-41(31-5,32-6)33-7)23-39-16-13-19-42(34-8,35-9)36-10;1-24(26)20-25(21-36-14-11-17-39(27-2,28-3)29-4,22-37-15-12-18-40(30-5,31-6)32-7)23-38-16-13-19-41(33-8,34-9)35-10;1-23(25)15-11-16-24(17-12-20-35(26-2,27-3)28-4,18-13-21-36(29-5,30-6)31-7)19-14-22-37(32-8,33-9)34-10;1-21(24)23-20-22(14-11-17-34(25-2,26-3)27-4,15-12-18-35(28-5,29-6)30-7)16-13-19-36(31-8,32-9)33-10;1-21(23)20-22(14-11-17-33(24-2,25-3)26-4,15-12-18-34(27-5,28-6)29-7)16-13-19-35(30-8,31-9)32-10;1-20(22)19-21(15-18-34(29-8,30-9)31-10,13-11-16-32(23-2,24-3)25-4)14-12-17-33(26-5,27-6)28-7;;;;;;/h1,11-23H2,2-10H3,(H,26,27);1,11-23H2,2-10H3;1,11-22H2,2-10H3;1,11-20H2,2-10H3,(H,23,24);1,11-20H2,2-10H3;1,11-19H2,2-10H3;;;;;;/q6*-1;;;;;;
InChIKeyILNGWFDAFQHGLY-UHFFFAOYSA-N
XLogP18.89
TPSA680.28 Ų
H-Bond Donors2
H-Bond Acceptors66
Rotatable Bonds151
Heavy Atoms231
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004674.55
LogP ≤ 518.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1066

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze 7-trimethoxysilyl-4,4-bis(3-trimethoxysilylpropyl)heptan-2-one;9-trimethoxysilyl-6,6-bis(3-trimethoxysilylpropyl)nonan-2-one;N-[5-trimethoxysilyl-2,2-bis(3-trimethoxysilylpropyl)pentyl]acetamide;5-(3-trimethoxysilylpropoxy)-4,4-bis(3-trimethoxysilylpropoxymethyl)pentan-2-one;N-[3-(3-trimethoxysilylpropoxy)-2,2-bis(3-trimethoxysilylpropoxymethyl)propyl]acetamide;7-trimethoxysilyl-4-(2-trimethoxysilylethyl)-4-(3-trimethoxysilylpropyl)heptan-2-one;tungsten with MolForge

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Frequently Asked Questions

What is the IUPAC name of 7-trimethoxysilyl-4,4-bis(3-trimethoxysilylpropyl)heptan-2-one;9-trimethoxysilyl-6,6-bis(3-trimethoxysilylpropyl)nonan-2-one;N-[5-trimethoxysilyl-2,2-bis(3-trimethoxysilylpropyl)pentyl]acetamide;5-(3-trimethoxysilylpropoxy)-4,4-bis(3-trimethoxysilylpropoxymethyl)pentan-2-one;N-[3-(3-trimethoxysilylpropoxy)-2,2-bis(3-trimethoxysilylpropoxymethyl)propyl]acetamide;7-trimethoxysilyl-4-(2-trimethoxysilylethyl)-4-(3-trimethoxysilylpropyl)heptan-2-one;tungsten?
The IUPAC name of 7-trimethoxysilyl-4,4-bis(3-trimethoxysilylpropyl)heptan-2-one;9-trimethoxysilyl-6,6-bis(3-trimethoxysilylpropyl)nonan-2-one;N-[5-trimethoxysilyl-2,2-bis(3-trimethoxysilylpropyl)pentyl]acetamide;5-(3-trimethoxysilylpropoxy)-4,4-bis(3-trimethoxysilylpropoxymethyl)pentan-2-one;N-[3-(3-trimethoxysilylpropoxy)-2,2-bis(3-trimethoxysilylpropoxymethyl)propyl]acetamide;7-trimethoxysilyl-4-(2-trimethoxysilylethyl)-4-(3-trimethoxysilylpropyl)heptan-2-one;tungsten (CID 159266725) is 7-trimethoxysilyl-4,4-bis(3-trimethoxysilylpropyl)heptan-2-one;9-trimethoxysilyl-6,6-bis(3-trimethoxysilylpropyl)nonan-2-one;N-[5-trimethoxysilyl-2,2-bis(3-trimethoxysilylpropyl)pentyl]acetamide;5-(3-trimethoxysilylpropoxy)-4,4-bis(3-trimethoxysilylpropoxymethyl)pentan-2-one;N-[3-(3-trimethoxysilylpropoxy)-2,2-bis(3-trimethoxysilylpropoxymethyl)propyl]acetamide;7-trimethoxysilyl-4-(2-trimethoxysilylethyl)-4-(3-trimethoxysilylpropyl)heptan-2-one;tungsten.
What is the SMILES notation for 7-trimethoxysilyl-4,4-bis(3-trimethoxysilylpropyl)heptan-2-one;9-trimethoxysilyl-6,6-bis(3-trimethoxysilylpropyl)nonan-2-one;N-[5-trimethoxysilyl-2,2-bis(3-trimethoxysilylpropyl)pentyl]acetamide;5-(3-trimethoxysilylpropoxy)-4,4-bis(3-trimethoxysilylpropoxymethyl)pentan-2-one;N-[3-(3-trimethoxysilylpropoxy)-2,2-bis(3-trimethoxysilylpropoxymethyl)propyl]acetamide;7-trimethoxysilyl-4-(2-trimethoxysilylethyl)-4-(3-trimethoxysilylpropyl)heptan-2-one;tungsten?
The canonical SMILES for 7-trimethoxysilyl-4,4-bis(3-trimethoxysilylpropyl)heptan-2-one;9-trimethoxysilyl-6,6-bis(3-trimethoxysilylpropyl)nonan-2-one;N-[5-trimethoxysilyl-2,2-bis(3-trimethoxysilylpropyl)pentyl]acetamide;5-(3-trimethoxysilylpropoxy)-4,4-bis(3-trimethoxysilylpropoxymethyl)pentan-2-one;N-[3-(3-trimethoxysilylpropoxy)-2,2-bis(3-trimethoxysilylpropoxymethyl)propyl]acetamide;7-trimethoxysilyl-4-(2-trimethoxysilylethyl)-4-(3-trimethoxysilylpropyl)heptan-2-one;tungsten is [CH2-]C(=O)CC(CCC[Si](OC)(OC)OC)(CCC[Si](OC)(OC)OC)CCC[Si](OC)(OC)OC.[CH2-]C(=O)CC(CCC[Si](OC)(OC)OC)(CCC[Si](OC)(OC)OC)CC[Si](OC)(OC)OC.[CH2-]C(=O)CC(COCCC[Si](OC)(OC)OC)(COCCC[Si](OC)(OC)OC)COCCC[Si](OC)(OC)OC.[CH2-]C(=O)CCCC(CCC[Si](OC)(OC)OC)(CCC[Si](OC)(OC)OC)CCC[Si](OC)(OC)OC.[CH2-]C(=O)NCC(CCC[Si](OC)(OC)OC)(CCC[Si](OC)(OC)OC)CCC[Si](OC)(OC)OC.[CH2-]C(=O)NCC(COCCC[Si](OC)(OC)OC)(COCCC[Si](OC)(OC)OC)COCCC[Si](OC)(OC)OC.[W].[W].[W].[W].[W].[W].
What is the InChIKey of 7-trimethoxysilyl-4,4-bis(3-trimethoxysilylpropyl)heptan-2-one;9-trimethoxysilyl-6,6-bis(3-trimethoxysilylpropyl)nonan-2-one;N-[5-trimethoxysilyl-2,2-bis(3-trimethoxysilylpropyl)pentyl]acetamide;5-(3-trimethoxysilylpropoxy)-4,4-bis(3-trimethoxysilylpropoxymethyl)pentan-2-one;N-[3-(3-trimethoxysilylpropoxy)-2,2-bis(3-trimethoxysilylpropoxymethyl)propyl]acetamide;7-trimethoxysilyl-4-(2-trimethoxysilylethyl)-4-(3-trimethoxysilylpropyl)heptan-2-one;tungsten?
The InChIKey is ILNGWFDAFQHGLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H56NO13Si3.C25H55O13Si3.C24H53O10Si3.C22H50NO10Si3.C22H49O10Si3.C21H47O10Si3.6W/c1-24(27)26-20-25(21-37-14-11-17-40(28-2,29-3)30-4,22-38-15-12-18-41(31-5,32-6)33-7)23-39-16-13-19-42(34-8,35-9)36-10;1-24(26)20-25(21-36-14-11-17-39(27-2,28-3)29-4,22-37-15-12-18-40(30-5,31-6)32-7)23-38-16-13-19-41(33-8,34-9)35-10;1-23(25)15-11-16-24(17-12-20-35(26-2,27-3)28-4,18-13-21-36(29-5,30-6)31-7)19-14-22-37(32-8,33-9)34-10;1-21(24)23-20-22(14-11-17-34(25-2,26-3)27-4,15-12-18-35(28-5,29-6)30-7)16-13-19-36(31-8,32-9)33-10;1-21(23)20-22(14-11-17-33(24-2,25-3)26-4,15-12-18-34(27-5,28-6)29-7)16-13-19-35(30-8,31-9)32-10;1-20(22)19-21(15-18-34(29-8,30-9)31-10,13-11-16-32(23-2,24-3)25-4)14-12-17-33(26-5,27-6)28-7;;;;;;/h1,11-23H2,2-10H3,(H,26,27);1,11-23H2,2-10H3;1,11-22H2,2-10H3;1,11-20H2,2-10H3,(H,23,24);1,11-20H2,2-10H3;1,11-19H2,2-10H3;;;;;;/q6*-1;;;;;;.
What are the key properties of 7-trimethoxysilyl-4,4-bis(3-trimethoxysilylpropyl)heptan-2-one;9-trimethoxysilyl-6,6-bis(3-trimethoxysilylpropyl)nonan-2-one;N-[5-trimethoxysilyl-2,2-bis(3-trimethoxysilylpropyl)pentyl]acetamide;5-(3-trimethoxysilylpropoxy)-4,4-bis(3-trimethoxysilylpropoxymethyl)pentan-2-one;N-[3-(3-trimethoxysilylpropoxy)-2,2-bis(3-trimethoxysilylpropoxymethyl)propyl]acetamide;7-trimethoxysilyl-4-(2-trimethoxysilylethyl)-4-(3-trimethoxysilylpropyl)heptan-2-one;tungsten?
7-trimethoxysilyl-4,4-bis(3-trimethoxysilylpropyl)heptan-2-one;9-trimethoxysilyl-6,6-bis(3-trimethoxysilylpropyl)nonan-2-one;N-[5-trimethoxysilyl-2,2-bis(3-trimethoxysilylpropyl)pentyl]acetamide;5-(3-trimethoxysilylpropoxy)-4,4-bis(3-trimethoxysilylpropoxymethyl)pentan-2-one;N-[3-(3-trimethoxysilylpropoxy)-2,2-bis(3-trimethoxysilylpropoxymethyl)propyl]acetamide;7-trimethoxysilyl-4-(2-trimethoxysilylethyl)-4-(3-trimethoxysilylpropyl)heptan-2-one;tungsten has a molecular weight of 4674.55 g/mol, XLogP of 18.89, 151 rotatable bonds, 2 hydrogen bond donors, and 66 hydrogen bond acceptors.
Where does this data come from?
All data for 7-trimethoxysilyl-4,4-bis(3-trimethoxysilylpropyl)heptan-2-one;9-trimethoxysilyl-6,6-bis(3-trimethoxysilylpropyl)nonan-2-one;N-[5-trimethoxysilyl-2,2-bis(3-trimethoxysilylpropyl)pentyl]acetamide;5-(3-trimethoxysilylpropoxy)-4,4-bis(3-trimethoxysilylpropoxymethyl)pentan-2-one;N-[3-(3-trimethoxysilylpropoxy)-2,2-bis(3-trimethoxysilylpropoxymethyl)propyl]acetamide;7-trimethoxysilyl-4-(2-trimethoxysilylethyl)-4-(3-trimethoxysilylpropyl)heptan-2-one;tungsten is sourced from PubChem (CID 159266725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).