1-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-[2-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-(6,6-dimethylheptoxy)-4,4-dimethylpentan-3-one;3,3-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]triazol-1-yl]butan-2-one;1-(8,8-dimethylnonoxy)-4,4-dimethylpentan-3-one;1-(7,7-dimethyloctoxy)-4,4-dimethylpentan-3-one;1-(10,10-dimethylundecoxy)-4,4-dimethylpentan-3-one;2,2,11,11-tetramethyldodecan-3-one;2,2,13,13-tetramethyltetradecan-3-one

C155H307N3O22 — CID 167583960

About 1-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-[2-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-(6,6-dimethylheptoxy)-4,4-dimethylpentan-3-one;3,3-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]triazol-1-yl]butan-2-one;1-(8,8-dimethylnonoxy)-4,4-dimethylpentan-3-one;1-(7,7-dimethyloctoxy)-4,4-dimethylpentan-3-one;1-(10,10-dimethylundecoxy)-4,4-dimethylpentan-3-one;2,2,11,11-tetramethyldodecan-3-one;2,2,13,13-tetramethyltetradecan-3-one

1-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-[2-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-(6,6-dimethylheptoxy)-4,4-dimethylpentan-3-one;3,3-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]triazol-1-yl]butan-2-one;1-(8,8-dimethylnonoxy)-4,4-dimethylpentan-3-one;1-(7,7-dimethyloctoxy)-4,4-dimethylpentan-3-one;1-(10,10-dimethylundecoxy)-4,4-dimethylpentan-3-one;2,2,11,11-tetramethyldodecan-3-one;2,2,13,13-tetramethyltetradecan-3-one (PubChem CID 167583960) has the molecular formula C155H307N3O22 and a molecular weight of 2565.16 g/mol. Its IUPAC name is 1-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-[2-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-(6,6-dimethylheptoxy)-4,4-dimethylpentan-3-one;3,3-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]triazol-1-yl]butan-2-one;1-(8,8-dimethylnonoxy)-4,4-dimethylpentan-3-one;1-(7,7-dimethyloctoxy)-4,4-dimethylpentan-3-one;1-(10,10-dimethylundecoxy)-4,4-dimethylpentan-3-one;2,2,11,11-tetramethyldodecan-3-one;2,2,13,13-tetramethyltetradecan-3-one.

Molecular Properties

• Compound Name: 1-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-[2-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-(6,6-dimethylheptoxy)-4,4-dimethylpentan-3-one;3,3-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]triazol-1-yl]butan-2-one;1-(8,8-dimethylnonoxy)-4,4-dimethylpentan-3-one;1-(7,7-dimethyloctoxy)-4,4-dimethylpentan-3-one;1-(10,10-dimethylundecoxy)-4,4-dimethylpentan-3-one;2,2,11,11-tetramethyldodecan-3-one;2,2,13,13-tetramethyltetradecan-3-one
• PubChem CID: 167583960
• Molecular Formula: C155H307N3O22
• Molecular Weight: 2565.16 g/mol
• Exact Mass: 2563.30
• IUPAC Name: 1-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-[2-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-(6,6-dimethylheptoxy)-4,4-dimethylpentan-3-one;3,3-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]triazol-1-yl]butan-2-one;1-(8,8-dimethylnonoxy)-4,4-dimethylpentan-3-one;1-(7,7-dimethyloctoxy)-4,4-dimethylpentan-3-one;1-(10,10-dimethylundecoxy)-4,4-dimethylpentan-3-one;2,2,11,11-tetramethyldodecan-3-one;2,2,13,13-tetramethyltetradecan-3-one
• SMILES: CC(C)(C)CCCCCCCC(=O)C(C)(C)C.CC(C)(C)CCCCCCCCCC(=O)C(C)(C)C.CC(C)(C)CCCCCCCCCOCCC(=O)C(C)(C)C.CC(C)(C)CCCCCCCOCCC(=O)C(C)(C)C.CC(C)(C)CCCCCCOCCC(=O)C(C)(C)C.CC(C)(C)CCCCCOCCC(=O)C(C)(C)C.CC(C)(C)CCOCCOCCOCCC(=O)C(C)(C)C.CC(C)(C)CCOCCOCCOCCOCCC(=O)C(C)(C)C.CC(C)(C)OCCOc1cn(CC(=O)C(C)(C)C)nn1
• InChI: InChI=1S/C20H40O2.C19H38O5.C18H36O2.C18H36O.C17H34O4.C17H34O2.C16H32O2.C16H32O.C14H25N3O3/c1-19(2,3)15-12-10-8-7-9-11-13-16-22-17-14-18(21)20(4,5)6;1-18(2,3)8-10-22-12-14-24-16-15-23-13-11-21-9-7-17(20)19(4,5)6;1-17(2,3)13-10-8-7-9-11-14-20-15-12-16(19)18(4,5)6;1-17(2,3)15-13-11-9-7-8-10-12-14-16(19)18(4,5)6;1-16(2,3)8-10-20-12-14-21-13-11-19-9-7-15(18)17(4,5)6;1-16(2,3)12-9-7-8-10-13-19-14-11-15(18)17(4,5)6;1-15(2,3)11-8-7-9-12-18-13-10-14(17)16(4,5)6;1-15(2,3)13-11-9-7-8-10-12-14(17)16(4,5)6;1-13(2,3)11(18)9-17-10-12(15-16-17)19-7-8-20-14(4,5)6/h7-17H2,1-6H3;7-16H2,1-6H3;7-15H2,1-6H3;7-15H2,1-6H3;7-14H2,1-6H3;7-14H2,1-6H3;7-13H2,1-6H3;7-13H2,1-6H3;10H,7-9H2,1-6H3
• InChIKey: HNSLYMRNMFMYLL-UHFFFAOYSA-N
• XLogP: 41.79
• TPSA: 304.33 Ų
• H-Bond Acceptors: 25
• Rotatable Bonds: 86
• Heavy Atoms: 180
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2565.16
LogP ≤ 5	41.79
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-[2-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-(6,6-dimethylheptoxy)-4,4-dimethylpentan-3-one;3,3-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]triazol-1-yl]butan-2-one;1-(8,8-dimethylnonoxy)-4,4-dimethylpentan-3-one;1-(7,7-dimethyloctoxy)-4,4-dimethylpentan-3-one;1-(10,10-dimethylundecoxy)-4,4-dimethylpentan-3-one;2,2,11,11-tetramethyldodecan-3-one;2,2,13,13-tetramethyltetradecan-3-one?

The IUPAC name of 1-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-[2-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-(6,6-dimethylheptoxy)-4,4-dimethylpentan-3-one;3,3-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]triazol-1-yl]butan-2-one;1-(8,8-dimethylnonoxy)-4,4-dimethylpentan-3-one;1-(7,7-dimethyloctoxy)-4,4-dimethylpentan-3-one;1-(10,10-dimethylundecoxy)-4,4-dimethylpentan-3-one;2,2,11,11-tetramethyldodecan-3-one;2,2,13,13-tetramethyltetradecan-3-one (CID 167583960) is 1-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-[2-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-(6,6-dimethylheptoxy)-4,4-dimethylpentan-3-one;3,3-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]triazol-1-yl]butan-2-one;1-(8,8-dimethylnonoxy)-4,4-dimethylpentan-3-one;1-(7,7-dimethyloctoxy)-4,4-dimethylpentan-3-one;1-(10,10-dimethylundecoxy)-4,4-dimethylpentan-3-one;2,2,11,11-tetramethyldodecan-3-one;2,2,13,13-tetramethyltetradecan-3-one.

What is the SMILES notation for 1-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-[2-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-(6,6-dimethylheptoxy)-4,4-dimethylpentan-3-one;3,3-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]triazol-1-yl]butan-2-one;1-(8,8-dimethylnonoxy)-4,4-dimethylpentan-3-one;1-(7,7-dimethyloctoxy)-4,4-dimethylpentan-3-one;1-(10,10-dimethylundecoxy)-4,4-dimethylpentan-3-one;2,2,11,11-tetramethyldodecan-3-one;2,2,13,13-tetramethyltetradecan-3-one?

The canonical SMILES for 1-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-[2-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-(6,6-dimethylheptoxy)-4,4-dimethylpentan-3-one;3,3-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]triazol-1-yl]butan-2-one;1-(8,8-dimethylnonoxy)-4,4-dimethylpentan-3-one;1-(7,7-dimethyloctoxy)-4,4-dimethylpentan-3-one;1-(10,10-dimethylundecoxy)-4,4-dimethylpentan-3-one;2,2,11,11-tetramethyldodecan-3-one;2,2,13,13-tetramethyltetradecan-3-one is CC(C)(C)CCCCCCCC(=O)C(C)(C)C.CC(C)(C)CCCCCCCCCC(=O)C(C)(C)C.CC(C)(C)CCCCCCCCCOCCC(=O)C(C)(C)C.CC(C)(C)CCCCCCCOCCC(=O)C(C)(C)C.CC(C)(C)CCCCCCOCCC(=O)C(C)(C)C.CC(C)(C)CCCCCOCCC(=O)C(C)(C)C.CC(C)(C)CCOCCOCCOCCC(=O)C(C)(C)C.CC(C)(C)CCOCCOCCOCCOCCC(=O)C(C)(C)C.CC(C)(C)OCCOc1cn(CC(=O)C(C)(C)C)nn1.

What is the InChIKey of 1-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-[2-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-(6,6-dimethylheptoxy)-4,4-dimethylpentan-3-one;3,3-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]triazol-1-yl]butan-2-one;1-(8,8-dimethylnonoxy)-4,4-dimethylpentan-3-one;1-(7,7-dimethyloctoxy)-4,4-dimethylpentan-3-one;1-(10,10-dimethylundecoxy)-4,4-dimethylpentan-3-one;2,2,11,11-tetramethyldodecan-3-one;2,2,13,13-tetramethyltetradecan-3-one?

The InChIKey is HNSLYMRNMFMYLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H40O2.C19H38O5.C18H36O2.C18H36O.C17H34O4.C17H34O2.C16H32O2.C16H32O.C14H25N3O3/c1-19(2,3)15-12-10-8-7-9-11-13-16-22-17-14-18(21)20(4,5)6;1-18(2,3)8-10-22-12-14-24-16-15-23-13-11-21-9-7-17(20)19(4,5)6;1-17(2,3)13-10-8-7-9-11-14-20-15-12-16(19)18(4,5)6;1-17(2,3)15-13-11-9-7-8-10-12-14-16(19)18(4,5)6;1-16(2,3)8-10-20-12-14-21-13-11-19-9-7-15(18)17(4,5)6;1-16(2,3)12-9-7-8-10-13-19-14-11-15(18)17(4,5)6;1-15(2,3)11-8-7-9-12-18-13-10-14(17)16(4,5)6;1-15(2,3)13-11-9-7-8-10-12-14(17)16(4,5)6;1-13(2,3)11(18)9-17-10-12(15-16-17)19-7-8-20-14(4,5)6/h7-17H2,1-6H3;7-16H2,1-6H3;7-15H2,1-6H3;7-15H2,1-6H3;7-14H2,1-6H3;7-14H2,1-6H3;7-13H2,1-6H3;7-13H2,1-6H3;10H,7-9H2,1-6H3.

What are the key properties of 1-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-[2-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-(6,6-dimethylheptoxy)-4,4-dimethylpentan-3-one;3,3-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]triazol-1-yl]butan-2-one;1-(8,8-dimethylnonoxy)-4,4-dimethylpentan-3-one;1-(7,7-dimethyloctoxy)-4,4-dimethylpentan-3-one;1-(10,10-dimethylundecoxy)-4,4-dimethylpentan-3-one;2,2,11,11-tetramethyldodecan-3-one;2,2,13,13-tetramethyltetradecan-3-one?

1-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-[2-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-(6,6-dimethylheptoxy)-4,4-dimethylpentan-3-one;3,3-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]triazol-1-yl]butan-2-one;1-(8,8-dimethylnonoxy)-4,4-dimethylpentan-3-one;1-(7,7-dimethyloctoxy)-4,4-dimethylpentan-3-one;1-(10,10-dimethylundecoxy)-4,4-dimethylpentan-3-one;2,2,11,11-tetramethyldodecan-3-one;2,2,13,13-tetramethyltetradecan-3-one has a molecular weight of 2565.16 g/mol, XLogP of 41.79, 86 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-[2-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-(6,6-dimethylheptoxy)-4,4-dimethylpentan-3-one;3,3-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]triazol-1-yl]butan-2-one;1-(8,8-dimethylnonoxy)-4,4-dimethylpentan-3-one;1-(7,7-dimethyloctoxy)-4,4-dimethylpentan-3-one;1-(10,10-dimethylundecoxy)-4,4-dimethylpentan-3-one;2,2,11,11-tetramethyldodecan-3-one;2,2,13,13-tetramethyltetradecan-3-one is sourced from PubChem (CID 167583960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).