1,3-dimethoxy-2,2-bis(methoxymethyl)propane;1,3-dimethoxy-2-[[3-methoxy-2,2-bis(methoxymethyl)propoxy]methyl]-2-(methoxymethyl)propane;1-methoxy-2,2-bis(methoxymethyl)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-(2-methoxypropoxy)propane;1,2,3-trimethoxypropane

C54H120O23 — CID 158744276

About 1,3-dimethoxy-2,2-bis(methoxymethyl)propane;1,3-dimethoxy-2-[[3-methoxy-2,2-bis(methoxymethyl)propoxy]methyl]-2-(methoxymethyl)propane;1-methoxy-2,2-bis(methoxymethyl)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-(2-methoxypropoxy)propane;1,2,3-trimethoxypropane

1,3-dimethoxy-2,2-bis(methoxymethyl)propane;1,3-dimethoxy-2-[[3-methoxy-2,2-bis(methoxymethyl)propoxy]methyl]-2-(methoxymethyl)propane;1-methoxy-2,2-bis(methoxymethyl)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-(2-methoxypropoxy)propane;1,2,3-trimethoxypropane (PubChem CID 158744276) has the molecular formula C54H120O23 and a molecular weight of 1137.53 g/mol. Its IUPAC name is 1,3-dimethoxy-2,2-bis(methoxymethyl)propane;1,3-dimethoxy-2-[[3-methoxy-2,2-bis(methoxymethyl)propoxy]methyl]-2-(methoxymethyl)propane;1-methoxy-2,2-bis(methoxymethyl)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-(2-methoxypropoxy)propane;1,2,3-trimethoxypropane.

Molecular Properties

• Compound Name: 1,3-dimethoxy-2,2-bis(methoxymethyl)propane;1,3-dimethoxy-2-[[3-methoxy-2,2-bis(methoxymethyl)propoxy]methyl]-2-(methoxymethyl)propane;1-methoxy-2,2-bis(methoxymethyl)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-(2-methoxypropoxy)propane;1,2,3-trimethoxypropane
• PubChem CID: 158744276
• Molecular Formula: C54H120O23
• Molecular Weight: 1137.53 g/mol
• Exact Mass: 1136.82
• IUPAC Name: 1,3-dimethoxy-2,2-bis(methoxymethyl)propane;1,3-dimethoxy-2-[[3-methoxy-2,2-bis(methoxymethyl)propoxy]methyl]-2-(methoxymethyl)propane;1-methoxy-2,2-bis(methoxymethyl)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-(2-methoxypropoxy)propane;1,2,3-trimethoxypropane
• SMILES: CCC(COC)(COC)COC.COCC(C)OCC(C)OC.COCC(COC)(COC)COC.COCC(COC)(COC)COCC(COC)(COC)COC.COCC(COC)OC.COCCOCCOC
• InChI: InChI=1S/C16H34O7.C9H20O4.C9H20O3.C8H18O3.2C6H14O3/c1-17-7-15(8-18-2,9-19-3)13-23-14-16(10-20-4,11-21-5)12-22-6;1-10-5-9(6-11-2,7-12-3)8-13-4;1-5-9(6-10-2,7-11-3)8-12-4;1-7(10-4)6-11-8(2)5-9-3;1-7-4-6(9-3)5-8-2;1-7-3-5-9-6-4-8-2/h7-14H2,1-6H3;5-8H2,1-4H3;5-8H2,1-4H3;7-8H,5-6H2,1-4H3;6H,4-5H2,1-3H3;3-6H2,1-2H3
• InChIKey: IMRNCBXLOCMXCO-UHFFFAOYSA-N
• XLogP: 4.40
• TPSA: 212.29 Ų
• H-Bond Acceptors: 23
• Rotatable Bonds: 48
• Heavy Atoms: 77
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1137.53
LogP ≤ 5	4.40
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethoxy-2,2-bis(methoxymethyl)propane;1,3-dimethoxy-2-[[3-methoxy-2,2-bis(methoxymethyl)propoxy]methyl]-2-(methoxymethyl)propane;1-methoxy-2,2-bis(methoxymethyl)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-(2-methoxypropoxy)propane;1,2,3-trimethoxypropane?

The IUPAC name of 1,3-dimethoxy-2,2-bis(methoxymethyl)propane;1,3-dimethoxy-2-[[3-methoxy-2,2-bis(methoxymethyl)propoxy]methyl]-2-(methoxymethyl)propane;1-methoxy-2,2-bis(methoxymethyl)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-(2-methoxypropoxy)propane;1,2,3-trimethoxypropane (CID 158744276) is 1,3-dimethoxy-2,2-bis(methoxymethyl)propane;1,3-dimethoxy-2-[[3-methoxy-2,2-bis(methoxymethyl)propoxy]methyl]-2-(methoxymethyl)propane;1-methoxy-2,2-bis(methoxymethyl)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-(2-methoxypropoxy)propane;1,2,3-trimethoxypropane.

What is the SMILES notation for 1,3-dimethoxy-2,2-bis(methoxymethyl)propane;1,3-dimethoxy-2-[[3-methoxy-2,2-bis(methoxymethyl)propoxy]methyl]-2-(methoxymethyl)propane;1-methoxy-2,2-bis(methoxymethyl)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-(2-methoxypropoxy)propane;1,2,3-trimethoxypropane?

The canonical SMILES for 1,3-dimethoxy-2,2-bis(methoxymethyl)propane;1,3-dimethoxy-2-[[3-methoxy-2,2-bis(methoxymethyl)propoxy]methyl]-2-(methoxymethyl)propane;1-methoxy-2,2-bis(methoxymethyl)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-(2-methoxypropoxy)propane;1,2,3-trimethoxypropane is CCC(COC)(COC)COC.COCC(C)OCC(C)OC.COCC(COC)(COC)COC.COCC(COC)(COC)COCC(COC)(COC)COC.COCC(COC)OC.COCCOCCOC.

What is the InChIKey of 1,3-dimethoxy-2,2-bis(methoxymethyl)propane;1,3-dimethoxy-2-[[3-methoxy-2,2-bis(methoxymethyl)propoxy]methyl]-2-(methoxymethyl)propane;1-methoxy-2,2-bis(methoxymethyl)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-(2-methoxypropoxy)propane;1,2,3-trimethoxypropane?

The InChIKey is IMRNCBXLOCMXCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34O7.C9H20O4.C9H20O3.C8H18O3.2C6H14O3/c1-17-7-15(8-18-2,9-19-3)13-23-14-16(10-20-4,11-21-5)12-22-6;1-10-5-9(6-11-2,7-12-3)8-13-4;1-5-9(6-10-2,7-11-3)8-12-4;1-7(10-4)6-11-8(2)5-9-3;1-7-4-6(9-3)5-8-2;1-7-3-5-9-6-4-8-2/h7-14H2,1-6H3;5-8H2,1-4H3;5-8H2,1-4H3;7-8H,5-6H2,1-4H3;6H,4-5H2,1-3H3;3-6H2,1-2H3.

What are the key properties of 1,3-dimethoxy-2,2-bis(methoxymethyl)propane;1,3-dimethoxy-2-[[3-methoxy-2,2-bis(methoxymethyl)propoxy]methyl]-2-(methoxymethyl)propane;1-methoxy-2,2-bis(methoxymethyl)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-(2-methoxypropoxy)propane;1,2,3-trimethoxypropane?

1,3-dimethoxy-2,2-bis(methoxymethyl)propane;1,3-dimethoxy-2-[[3-methoxy-2,2-bis(methoxymethyl)propoxy]methyl]-2-(methoxymethyl)propane;1-methoxy-2,2-bis(methoxymethyl)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-(2-methoxypropoxy)propane;1,2,3-trimethoxypropane has a molecular weight of 1137.53 g/mol, XLogP of 4.40, 48 rotatable bonds, 0 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 1,3-dimethoxy-2,2-bis(methoxymethyl)propane;1,3-dimethoxy-2-[[3-methoxy-2,2-bis(methoxymethyl)propoxy]methyl]-2-(methoxymethyl)propane;1-methoxy-2,2-bis(methoxymethyl)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-(2-methoxypropoxy)propane;1,2,3-trimethoxypropane is sourced from PubChem (CID 158744276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).