[2,3-bis(2-methylprop-2-enoyloxymethoxy)-2-(2-methylprop-2-enoyloxymethoxymethyl)propoxy]methyl 2-methylprop-2-enoate;[5-methyl-2-(2-methylprop-2-enoyloxy)-2-(2-methylprop-2-enoyloxymethyl)-4-oxohex-5-enyl] 2-methylprop-2-enoate

C44H60O19 — CID 157485260

About [2,3-bis(2-methylprop-2-enoyloxymethoxy)-2-(2-methylprop-2-enoyloxymethoxymethyl)propoxy]methyl 2-methylprop-2-enoate;[5-methyl-2-(2-methylprop-2-enoyloxy)-2-(2-methylprop-2-enoyloxymethyl)-4-oxohex-5-enyl] 2-methylprop-2-enoate

[2,3-bis(2-methylprop-2-enoyloxymethoxy)-2-(2-methylprop-2-enoyloxymethoxymethyl)propoxy]methyl 2-methylprop-2-enoate;[5-methyl-2-(2-methylprop-2-enoyloxy)-2-(2-methylprop-2-enoyloxymethyl)-4-oxohex-5-enyl] 2-methylprop-2-enoate (PubChem CID 157485260) has the molecular formula C44H60O19 and a molecular weight of 892.94 g/mol. Its IUPAC name is [2,3-bis(2-methylprop-2-enoyloxymethoxy)-2-(2-methylprop-2-enoyloxymethoxymethyl)propoxy]methyl 2-methylprop-2-enoate;[5-methyl-2-(2-methylprop-2-enoyloxy)-2-(2-methylprop-2-enoyloxymethyl)-4-oxohex-5-enyl] 2-methylprop-2-enoate.

Molecular Properties

• Compound Name: [2,3-bis(2-methylprop-2-enoyloxymethoxy)-2-(2-methylprop-2-enoyloxymethoxymethyl)propoxy]methyl 2-methylprop-2-enoate;[5-methyl-2-(2-methylprop-2-enoyloxy)-2-(2-methylprop-2-enoyloxymethyl)-4-oxohex-5-enyl] 2-methylprop-2-enoate
• PubChem CID: 157485260
• Molecular Formula: C44H60O19
• Molecular Weight: 892.94 g/mol
• Exact Mass: 892.37
• IUPAC Name: [2,3-bis(2-methylprop-2-enoyloxymethoxy)-2-(2-methylprop-2-enoyloxymethoxymethyl)propoxy]methyl 2-methylprop-2-enoate;[5-methyl-2-(2-methylprop-2-enoyloxy)-2-(2-methylprop-2-enoyloxymethyl)-4-oxohex-5-enyl] 2-methylprop-2-enoate
• SMILES: C=C(C)C(=O)CC(COC(=O)C(=C)C)(COC(=O)C(=C)C)OC(=O)C(=C)C.C=C(C)C(=O)OCOCC(COCOC(=O)C(=C)C)(COCOC(=O)C(=C)C)OCOC(=O)C(=C)C
• InChI: InChI=1S/C24H34O12.C20H26O7/c1-16(2)20(25)32-12-29-9-24(36-15-35-23(28)19(7)8,10-30-13-33-21(26)17(3)4)11-31-14-34-22(27)18(5)6;1-12(2)16(21)9-20(27-19(24)15(7)8,10-25-17(22)13(3)4)11-26-18(23)14(5)6/h1,3,5,7,9-15H2,2,4,6,8H3;1,3,5,7,9-11H2,2,4,6,8H3
• InChIKey: BWQGLSFJXQILIR-UHFFFAOYSA-N
• XLogP: 4.72
• TPSA: 238.09 Ų
• H-Bond Acceptors: 19
• Rotatable Bonds: 30
• Heavy Atoms: 63
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	892.94
LogP ≤ 5	4.72
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	19

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [2,3-bis(2-methylprop-2-enoyloxymethoxy)-2-(2-methylprop-2-enoyloxymethoxymethyl)propoxy]methyl 2-methylprop-2-enoate;[5-methyl-2-(2-methylprop-2-enoyloxy)-2-(2-methylprop-2-enoyloxymethyl)-4-oxohex-5-enyl] 2-methylprop-2-enoate?

The IUPAC name of [2,3-bis(2-methylprop-2-enoyloxymethoxy)-2-(2-methylprop-2-enoyloxymethoxymethyl)propoxy]methyl 2-methylprop-2-enoate;[5-methyl-2-(2-methylprop-2-enoyloxy)-2-(2-methylprop-2-enoyloxymethyl)-4-oxohex-5-enyl] 2-methylprop-2-enoate (CID 157485260) is [2,3-bis(2-methylprop-2-enoyloxymethoxy)-2-(2-methylprop-2-enoyloxymethoxymethyl)propoxy]methyl 2-methylprop-2-enoate;[5-methyl-2-(2-methylprop-2-enoyloxy)-2-(2-methylprop-2-enoyloxymethyl)-4-oxohex-5-enyl] 2-methylprop-2-enoate.

What is the SMILES notation for [2,3-bis(2-methylprop-2-enoyloxymethoxy)-2-(2-methylprop-2-enoyloxymethoxymethyl)propoxy]methyl 2-methylprop-2-enoate;[5-methyl-2-(2-methylprop-2-enoyloxy)-2-(2-methylprop-2-enoyloxymethyl)-4-oxohex-5-enyl] 2-methylprop-2-enoate?

The canonical SMILES for [2,3-bis(2-methylprop-2-enoyloxymethoxy)-2-(2-methylprop-2-enoyloxymethoxymethyl)propoxy]methyl 2-methylprop-2-enoate;[5-methyl-2-(2-methylprop-2-enoyloxy)-2-(2-methylprop-2-enoyloxymethyl)-4-oxohex-5-enyl] 2-methylprop-2-enoate is C=C(C)C(=O)CC(COC(=O)C(=C)C)(COC(=O)C(=C)C)OC(=O)C(=C)C.C=C(C)C(=O)OCOCC(COCOC(=O)C(=C)C)(COCOC(=O)C(=C)C)OCOC(=O)C(=C)C.

What is the InChIKey of [2,3-bis(2-methylprop-2-enoyloxymethoxy)-2-(2-methylprop-2-enoyloxymethoxymethyl)propoxy]methyl 2-methylprop-2-enoate;[5-methyl-2-(2-methylprop-2-enoyloxy)-2-(2-methylprop-2-enoyloxymethyl)-4-oxohex-5-enyl] 2-methylprop-2-enoate?

The InChIKey is BWQGLSFJXQILIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H34O12.C20H26O7/c1-16(2)20(25)32-12-29-9-24(36-15-35-23(28)19(7)8,10-30-13-33-21(26)17(3)4)11-31-14-34-22(27)18(5)6;1-12(2)16(21)9-20(27-19(24)15(7)8,10-25-17(22)13(3)4)11-26-18(23)14(5)6/h1,3,5,7,9-15H2,2,4,6,8H3;1,3,5,7,9-11H2,2,4,6,8H3.

What are the key properties of [2,3-bis(2-methylprop-2-enoyloxymethoxy)-2-(2-methylprop-2-enoyloxymethoxymethyl)propoxy]methyl 2-methylprop-2-enoate;[5-methyl-2-(2-methylprop-2-enoyloxy)-2-(2-methylprop-2-enoyloxymethyl)-4-oxohex-5-enyl] 2-methylprop-2-enoate?

[2,3-bis(2-methylprop-2-enoyloxymethoxy)-2-(2-methylprop-2-enoyloxymethoxymethyl)propoxy]methyl 2-methylprop-2-enoate;[5-methyl-2-(2-methylprop-2-enoyloxy)-2-(2-methylprop-2-enoyloxymethyl)-4-oxohex-5-enyl] 2-methylprop-2-enoate has a molecular weight of 892.94 g/mol, XLogP of 4.72, 30 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for [2,3-bis(2-methylprop-2-enoyloxymethoxy)-2-(2-methylprop-2-enoyloxymethoxymethyl)propoxy]methyl 2-methylprop-2-enoate;[5-methyl-2-(2-methylprop-2-enoyloxy)-2-(2-methylprop-2-enoyloxymethyl)-4-oxohex-5-enyl] 2-methylprop-2-enoate is sourced from PubChem (CID 157485260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).