2-[2-methoxyethyl(2-propan-2-yloxyethyl)phosphanyl]ethanol;[methoxymethyl(propan-2-yloxymethyl)phosphanyl]methanol;3-[(3-methoxy-3-oxopropyl)-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;3-[3-methoxypropyl(3-propan-2-yloxypropyl)phosphanyl]propan-1-ol;3-[3-oxobutyl-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;5-[5-oxohexyl-(5-oxo-5-propan-2-yloxypentyl)phosphanyl]pentanoic acid;4-[4-oxopentyl-(4-oxo-4-propan-2-yloxybutyl)phosphanyl]butanoic acid;tetrakis(sulfur trioxide)

C91H179O42P7S4 — CID 167549747

About 2-[2-methoxyethyl(2-propan-2-yloxyethyl)phosphanyl]ethanol;[methoxymethyl(propan-2-yloxymethyl)phosphanyl]methanol;3-[(3-methoxy-3-oxopropyl)-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;3-[3-methoxypropyl(3-propan-2-yloxypropyl)phosphanyl]propan-1-ol;3-[3-oxobutyl-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;5-[5-oxohexyl-(5-oxo-5-propan-2-yloxypentyl)phosphanyl]pentanoic acid;4-[4-oxopentyl-(4-oxo-4-propan-2-yloxybutyl)phosphanyl]butanoic acid;tetrakis(sulfur trioxide)

2-[2-methoxyethyl(2-propan-2-yloxyethyl)phosphanyl]ethanol;[methoxymethyl(propan-2-yloxymethyl)phosphanyl]methanol;3-[(3-methoxy-3-oxopropyl)-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;3-[3-methoxypropyl(3-propan-2-yloxypropyl)phosphanyl]propan-1-ol;3-[3-oxobutyl-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;5-[5-oxohexyl-(5-oxo-5-propan-2-yloxypentyl)phosphanyl]pentanoic acid;4-[4-oxopentyl-(4-oxo-4-propan-2-yloxybutyl)phosphanyl]butanoic acid;tetrakis(sulfur trioxide) (PubChem CID 167549747) has the molecular formula C91H179O42P7S4 and a molecular weight of 2290.48 g/mol. Its IUPAC name is 2-[2-methoxyethyl(2-propan-2-yloxyethyl)phosphanyl]ethanol;[methoxymethyl(propan-2-yloxymethyl)phosphanyl]methanol;3-[(3-methoxy-3-oxopropyl)-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;3-[3-methoxypropyl(3-propan-2-yloxypropyl)phosphanyl]propan-1-ol;3-[3-oxobutyl-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;5-[5-oxohexyl-(5-oxo-5-propan-2-yloxypentyl)phosphanyl]pentanoic acid;4-[4-oxopentyl-(4-oxo-4-propan-2-yloxybutyl)phosphanyl]butanoic acid;tetrakis(sulfur trioxide).

Molecular Properties

• Compound Name: 2-[2-methoxyethyl(2-propan-2-yloxyethyl)phosphanyl]ethanol;[methoxymethyl(propan-2-yloxymethyl)phosphanyl]methanol;3-[(3-methoxy-3-oxopropyl)-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;3-[3-methoxypropyl(3-propan-2-yloxypropyl)phosphanyl]propan-1-ol;3-[3-oxobutyl-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;5-[5-oxohexyl-(5-oxo-5-propan-2-yloxypentyl)phosphanyl]pentanoic acid;4-[4-oxopentyl-(4-oxo-4-propan-2-yloxybutyl)phosphanyl]butanoic acid;tetrakis(sulfur trioxide)
• PubChem CID: 167549747
• Molecular Formula: C91H179O42P7S4
• Molecular Weight: 2290.48 g/mol
• Exact Mass: 2288.89
• IUPAC Name: 2-[2-methoxyethyl(2-propan-2-yloxyethyl)phosphanyl]ethanol;[methoxymethyl(propan-2-yloxymethyl)phosphanyl]methanol;3-[(3-methoxy-3-oxopropyl)-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;3-[3-methoxypropyl(3-propan-2-yloxypropyl)phosphanyl]propan-1-ol;3-[3-oxobutyl-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;5-[5-oxohexyl-(5-oxo-5-propan-2-yloxypentyl)phosphanyl]pentanoic acid;4-[4-oxopentyl-(4-oxo-4-propan-2-yloxybutyl)phosphanyl]butanoic acid;tetrakis(sulfur trioxide)
• SMILES: CC(=O)CCCCP(CCCCC(=O)O)CCCCC(=O)OC(C)C.CC(=O)CCCP(CCCC(=O)O)CCCC(=O)OC(C)C.CC(=O)CCP(CCC(=O)O)CCC(=O)OC(C)C.COC(=O)CCP(CCC(=O)O)CCC(=O)OC(C)C.COCCCP(CCCO)CCCOC(C)C.COCCP(CCO)CCOC(C)C.COCP(CO)COC(C)C.O=S(=O)=O.O=S(=O)=O.O=S(=O)=O.O=S(=O)=O
• InChI: InChI=1S/C19H35O5P.C16H29O5P.C13H23O6P.C13H23O5P.C13H29O3P.C10H23O3P.C7H17O3P.4O3S/c1-16(2)24-19(23)12-6-9-15-25(13-7-4-10-17(3)20)14-8-5-11-18(21)22;1-13(2)21-16(20)9-6-12-22(10-4-7-14(3)17)11-5-8-15(18)19;1-10(2)19-13(17)6-9-20(7-4-11(14)15)8-5-12(16)18-3;1-10(2)18-13(17)6-9-19(7-4-11(3)14)8-5-12(15)16;1-13(2)16-9-6-12-17(10-4-7-14)11-5-8-15-3;1-10(2)13-6-9-14(7-4-11)8-5-12-3;1-7(2)10-6-11(4-8)5-9-3;4*1-4(2)3/h16H,4-15H2,1-3H3,(H,21,22);13H,4-12H2,1-3H3,(H,18,19);10H,4-9H2,1-3H3,(H,14,15);10H,4-9H2,1-3H3,(H,15,16);13-14H,4-12H2,1-3H3;10-11H,4-9H2,1-3H3;7-8H,4-6H2,1-3H3
• InChIKey: CGEIYQFMBIENSF-UHFFFAOYSA-N
• XLogP: 13.77
• TPSA: 652.82 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 38
• Rotatable Bonds: 76
• Heavy Atoms: 144
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2290.48
LogP ≤ 5	13.77
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	38

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[2-methoxyethyl(2-propan-2-yloxyethyl)phosphanyl]ethanol;[methoxymethyl(propan-2-yloxymethyl)phosphanyl]methanol;3-[(3-methoxy-3-oxopropyl)-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;3-[3-methoxypropyl(3-propan-2-yloxypropyl)phosphanyl]propan-1-ol;3-[3-oxobutyl-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;5-[5-oxohexyl-(5-oxo-5-propan-2-yloxypentyl)phosphanyl]pentanoic acid;4-[4-oxopentyl-(4-oxo-4-propan-2-yloxybutyl)phosphanyl]butanoic acid;tetrakis(sulfur trioxide)?

The IUPAC name of 2-[2-methoxyethyl(2-propan-2-yloxyethyl)phosphanyl]ethanol;[methoxymethyl(propan-2-yloxymethyl)phosphanyl]methanol;3-[(3-methoxy-3-oxopropyl)-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;3-[3-methoxypropyl(3-propan-2-yloxypropyl)phosphanyl]propan-1-ol;3-[3-oxobutyl-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;5-[5-oxohexyl-(5-oxo-5-propan-2-yloxypentyl)phosphanyl]pentanoic acid;4-[4-oxopentyl-(4-oxo-4-propan-2-yloxybutyl)phosphanyl]butanoic acid;tetrakis(sulfur trioxide) (CID 167549747) is 2-[2-methoxyethyl(2-propan-2-yloxyethyl)phosphanyl]ethanol;[methoxymethyl(propan-2-yloxymethyl)phosphanyl]methanol;3-[(3-methoxy-3-oxopropyl)-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;3-[3-methoxypropyl(3-propan-2-yloxypropyl)phosphanyl]propan-1-ol;3-[3-oxobutyl-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;5-[5-oxohexyl-(5-oxo-5-propan-2-yloxypentyl)phosphanyl]pentanoic acid;4-[4-oxopentyl-(4-oxo-4-propan-2-yloxybutyl)phosphanyl]butanoic acid;tetrakis(sulfur trioxide).

What is the SMILES notation for 2-[2-methoxyethyl(2-propan-2-yloxyethyl)phosphanyl]ethanol;[methoxymethyl(propan-2-yloxymethyl)phosphanyl]methanol;3-[(3-methoxy-3-oxopropyl)-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;3-[3-methoxypropyl(3-propan-2-yloxypropyl)phosphanyl]propan-1-ol;3-[3-oxobutyl-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;5-[5-oxohexyl-(5-oxo-5-propan-2-yloxypentyl)phosphanyl]pentanoic acid;4-[4-oxopentyl-(4-oxo-4-propan-2-yloxybutyl)phosphanyl]butanoic acid;tetrakis(sulfur trioxide)?

The canonical SMILES for 2-[2-methoxyethyl(2-propan-2-yloxyethyl)phosphanyl]ethanol;[methoxymethyl(propan-2-yloxymethyl)phosphanyl]methanol;3-[(3-methoxy-3-oxopropyl)-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;3-[3-methoxypropyl(3-propan-2-yloxypropyl)phosphanyl]propan-1-ol;3-[3-oxobutyl-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;5-[5-oxohexyl-(5-oxo-5-propan-2-yloxypentyl)phosphanyl]pentanoic acid;4-[4-oxopentyl-(4-oxo-4-propan-2-yloxybutyl)phosphanyl]butanoic acid;tetrakis(sulfur trioxide) is CC(=O)CCCCP(CCCCC(=O)O)CCCCC(=O)OC(C)C.CC(=O)CCCP(CCCC(=O)O)CCCC(=O)OC(C)C.CC(=O)CCP(CCC(=O)O)CCC(=O)OC(C)C.COC(=O)CCP(CCC(=O)O)CCC(=O)OC(C)C.COCCCP(CCCO)CCCOC(C)C.COCCP(CCO)CCOC(C)C.COCP(CO)COC(C)C.O=S(=O)=O.O=S(=O)=O.O=S(=O)=O.O=S(=O)=O.

What is the InChIKey of 2-[2-methoxyethyl(2-propan-2-yloxyethyl)phosphanyl]ethanol;[methoxymethyl(propan-2-yloxymethyl)phosphanyl]methanol;3-[(3-methoxy-3-oxopropyl)-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;3-[3-methoxypropyl(3-propan-2-yloxypropyl)phosphanyl]propan-1-ol;3-[3-oxobutyl-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;5-[5-oxohexyl-(5-oxo-5-propan-2-yloxypentyl)phosphanyl]pentanoic acid;4-[4-oxopentyl-(4-oxo-4-propan-2-yloxybutyl)phosphanyl]butanoic acid;tetrakis(sulfur trioxide)?

The InChIKey is CGEIYQFMBIENSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H35O5P.C16H29O5P.C13H23O6P.C13H23O5P.C13H29O3P.C10H23O3P.C7H17O3P.4O3S/c1-16(2)24-19(23)12-6-9-15-25(13-7-4-10-17(3)20)14-8-5-11-18(21)22;1-13(2)21-16(20)9-6-12-22(10-4-7-14(3)17)11-5-8-15(18)19;1-10(2)19-13(17)6-9-20(7-4-11(14)15)8-5-12(16)18-3;1-10(2)18-13(17)6-9-19(7-4-11(3)14)8-5-12(15)16;1-13(2)16-9-6-12-17(10-4-7-14)11-5-8-15-3;1-10(2)13-6-9-14(7-4-11)8-5-12-3;1-7(2)10-6-11(4-8)5-9-3;4*1-4(2)3/h16H,4-15H2,1-3H3,(H,21,22);13H,4-12H2,1-3H3,(H,18,19);10H,4-9H2,1-3H3,(H,14,15);10H,4-9H2,1-3H3,(H,15,16);13-14H,4-12H2,1-3H3;10-11H,4-9H2,1-3H3;7-8H,4-6H2,1-3H3;;;;.

What are the key properties of 2-[2-methoxyethyl(2-propan-2-yloxyethyl)phosphanyl]ethanol;[methoxymethyl(propan-2-yloxymethyl)phosphanyl]methanol;3-[(3-methoxy-3-oxopropyl)-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;3-[3-methoxypropyl(3-propan-2-yloxypropyl)phosphanyl]propan-1-ol;3-[3-oxobutyl-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;5-[5-oxohexyl-(5-oxo-5-propan-2-yloxypentyl)phosphanyl]pentanoic acid;4-[4-oxopentyl-(4-oxo-4-propan-2-yloxybutyl)phosphanyl]butanoic acid;tetrakis(sulfur trioxide)?

2-[2-methoxyethyl(2-propan-2-yloxyethyl)phosphanyl]ethanol;[methoxymethyl(propan-2-yloxymethyl)phosphanyl]methanol;3-[(3-methoxy-3-oxopropyl)-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;3-[3-methoxypropyl(3-propan-2-yloxypropyl)phosphanyl]propan-1-ol;3-[3-oxobutyl-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;5-[5-oxohexyl-(5-oxo-5-propan-2-yloxypentyl)phosphanyl]pentanoic acid;4-[4-oxopentyl-(4-oxo-4-propan-2-yloxybutyl)phosphanyl]butanoic acid;tetrakis(sulfur trioxide) has a molecular weight of 2290.48 g/mol, XLogP of 13.77, 76 rotatable bonds, 7 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[2-methoxyethyl(2-propan-2-yloxyethyl)phosphanyl]ethanol;[methoxymethyl(propan-2-yloxymethyl)phosphanyl]methanol;3-[(3-methoxy-3-oxopropyl)-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;3-[3-methoxypropyl(3-propan-2-yloxypropyl)phosphanyl]propan-1-ol;3-[3-oxobutyl-(3-oxo-3-propan-2-yloxypropyl)phosphanyl]propanoic acid;5-[5-oxohexyl-(5-oxo-5-propan-2-yloxypentyl)phosphanyl]pentanoic acid;4-[4-oxopentyl-(4-oxo-4-propan-2-yloxybutyl)phosphanyl]butanoic acid;tetrakis(sulfur trioxide) is sourced from PubChem (CID 167549747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).