ethane;2-[4-[[4-[4-(2-methylprop-2-enoyloxy)phenyl]phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;[4-[3-(2-methylprop-2-enoyloxy)propyl]phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-(4-prop-2-enoyloxyphenyl)benzoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl prop-2-enoate;[4-[4-[[4-(3-prop-2-enoyloxypropyl)phenoxy]methyl]phenyl]phenyl] 2-methylprop-2-enoate

C243H312O38 — CID 159623252

About ethane;2-[4-[[4-[4-(2-methylprop-2-enoyloxy)phenyl]phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;[4-[3-(2-methylprop-2-enoyloxy)propyl]phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-(4-prop-2-enoyloxyphenyl)benzoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl prop-2-enoate;[4-[4-[[4-(3-prop-2-enoyloxypropyl)phenoxy]methyl]phenyl]phenyl] 2-methylprop-2-enoate

ethane;2-[4-[[4-[4-(2-methylprop-2-enoyloxy)phenyl]phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;[4-[3-(2-methylprop-2-enoyloxy)propyl]phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-(4-prop-2-enoyloxyphenyl)benzoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl prop-2-enoate;[4-[4-[[4-(3-prop-2-enoyloxypropyl)phenoxy]methyl]phenyl]phenyl] 2-methylprop-2-enoate (PubChem CID 159623252) has the molecular formula C243H312O38 and a molecular weight of 3841.13 g/mol. Its IUPAC name is ethane;2-[4-[[4-[4-(2-methylprop-2-enoyloxy)phenyl]phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;[4-[3-(2-methylprop-2-enoyloxy)propyl]phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-(4-prop-2-enoyloxyphenyl)benzoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl prop-2-enoate;[4-[4-[[4-(3-prop-2-enoyloxypropyl)phenoxy]methyl]phenyl]phenyl] 2-methylprop-2-enoate.

Molecular Properties

• Compound Name: ethane;2-[4-[[4-[4-(2-methylprop-2-enoyloxy)phenyl]phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;[4-[3-(2-methylprop-2-enoyloxy)propyl]phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-(4-prop-2-enoyloxyphenyl)benzoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl prop-2-enoate;[4-[4-[[4-(3-prop-2-enoyloxypropyl)phenoxy]methyl]phenyl]phenyl] 2-methylprop-2-enoate
• PubChem CID: 159623252
• Molecular Formula: C243H312O38
• Molecular Weight: 3841.13 g/mol
• Exact Mass: 3838.25
• IUPAC Name: ethane;2-[4-[[4-[4-(2-methylprop-2-enoyloxy)phenyl]phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;[4-[3-(2-methylprop-2-enoyloxy)propyl]phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-(4-prop-2-enoyloxyphenyl)benzoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl prop-2-enoate;[4-[4-[[4-(3-prop-2-enoyloxypropyl)phenoxy]methyl]phenyl]phenyl] 2-methylprop-2-enoate
• SMILES: C=C(C)C(=O)OCC(C)c1ccc(OCc2ccc(-c3ccc(OC(=O)C(=C)C)cc3)cc2)cc1.C=C(C)C(=O)OCCCc1ccc(OC(=O)c2ccc(-c3ccc(OC(=O)C(=C)C)cc3)cc2)cc1.C=CC(=O)OCCCc1ccc(OCc2ccc(-c3ccc(OC(=O)C(=C)C)cc3)cc2)cc1.C=CC(=O)OCCCc1ccc(OCc2ccc(-c3ccc(OC(=O)C=C)cc3)cc2)cc1.C=CC(=O)OCCc1ccc(OC(=O)c2ccc(-c3ccc(OC(=O)C(=C)C)cc3)cc2)cc1.C=CC(=O)OCCc1ccc(OC(=O)c2ccc(-c3ccc(OC(=O)C=C)cc3)cc2)cc1.C=CC(=O)Oc1ccc(-c2ccc(COc3ccc(CCCOC(=O)C(=C)C)cc3)cc2)cc1.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC
• InChI: InChI=1S/C30H28O6.C30H30O5.2C29H28O5.C28H24O6.C28H26O5.C27H22O6.21C2H6/c1-20(2)28(31)34-19-5-6-22-7-15-26(16-8-22)36-30(33)25-11-9-23(10-12-25)24-13-17-27(18-14-24)35-29(32)21(3)4;1-20(2)29(31)34-18-22(5)24-10-14-27(15-11-24)33-19-23-6-8-25(9-7-23)26-12-16-28(17-13-26)35-30(32)21(3)4;1-4-28(30)34-27-17-13-25(14-18-27)24-11-7-23(8-12-24)20-33-26-15-9-22(10-16-26)6-5-19-32-29(31)21(2)3;1-4-28(30)32-19-5-6-22-9-15-26(16-10-22)33-20-23-7-11-24(12-8-23)25-13-17-27(18-14-25)34-29(31)21(2)3;1-4-26(29)32-18-17-20-5-13-24(14-6-20)34-28(31)23-9-7-21(8-10-23)22-11-15-25(16-12-22)33-27(30)19(2)3;1-3-27(29)31-19-5-6-21-9-15-25(16-10-21)32-20-22-7-11-23(12-8-22)24-13-17-26(18-14-24)33-28(30)4-2;1-3-25(28)31-18-17-19-5-13-24(14-6-19)33-27(30)22-9-7-20(8-10-22)21-11-15-23(16-12-21)32-26(29)4-2;21*1-2/h7-18H,1,3,5-6,19H2,2,4H3;6-17,22H,1,3,18-19H2,2,4-5H3;2*4,7-18H,1-2,5-6,19-20H2,3H3;4-16H,1-2,17-18H2,3H3;3-4,7-18H,1-2,5-6,19-20H2;3-16H,1-2,17-18H2;21*1-2H3
• InChIKey: MODWFCWLJUZWSV-UHFFFAOYSA-N
• XLogP: 62.39
• TPSA: 484.02 Ų
• H-Bond Acceptors: 38
• Rotatable Bonds: 71
• Heavy Atoms: 281
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3841.13
LogP ≤ 5	62.39
H-Bond Donors ≤ 5	0
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': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'phenol_ester', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of ethane;2-[4-[[4-[4-(2-methylprop-2-enoyloxy)phenyl]phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;[4-[3-(2-methylprop-2-enoyloxy)propyl]phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-(4-prop-2-enoyloxyphenyl)benzoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl prop-2-enoate;[4-[4-[[4-(3-prop-2-enoyloxypropyl)phenoxy]methyl]phenyl]phenyl] 2-methylprop-2-enoate?

The IUPAC name of ethane;2-[4-[[4-[4-(2-methylprop-2-enoyloxy)phenyl]phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;[4-[3-(2-methylprop-2-enoyloxy)propyl]phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-(4-prop-2-enoyloxyphenyl)benzoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl prop-2-enoate;[4-[4-[[4-(3-prop-2-enoyloxypropyl)phenoxy]methyl]phenyl]phenyl] 2-methylprop-2-enoate (CID 159623252) is ethane;2-[4-[[4-[4-(2-methylprop-2-enoyloxy)phenyl]phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;[4-[3-(2-methylprop-2-enoyloxy)propyl]phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-(4-prop-2-enoyloxyphenyl)benzoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl prop-2-enoate;[4-[4-[[4-(3-prop-2-enoyloxypropyl)phenoxy]methyl]phenyl]phenyl] 2-methylprop-2-enoate.

What is the SMILES notation for ethane;2-[4-[[4-[4-(2-methylprop-2-enoyloxy)phenyl]phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;[4-[3-(2-methylprop-2-enoyloxy)propyl]phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-(4-prop-2-enoyloxyphenyl)benzoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl prop-2-enoate;[4-[4-[[4-(3-prop-2-enoyloxypropyl)phenoxy]methyl]phenyl]phenyl] 2-methylprop-2-enoate?

The canonical SMILES for ethane;2-[4-[[4-[4-(2-methylprop-2-enoyloxy)phenyl]phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;[4-[3-(2-methylprop-2-enoyloxy)propyl]phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-(4-prop-2-enoyloxyphenyl)benzoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl prop-2-enoate;[4-[4-[[4-(3-prop-2-enoyloxypropyl)phenoxy]methyl]phenyl]phenyl] 2-methylprop-2-enoate is C=C(C)C(=O)OCC(C)c1ccc(OCc2ccc(-c3ccc(OC(=O)C(=C)C)cc3)cc2)cc1.C=C(C)C(=O)OCCCc1ccc(OC(=O)c2ccc(-c3ccc(OC(=O)C(=C)C)cc3)cc2)cc1.C=CC(=O)OCCCc1ccc(OCc2ccc(-c3ccc(OC(=O)C(=C)C)cc3)cc2)cc1.C=CC(=O)OCCCc1ccc(OCc2ccc(-c3ccc(OC(=O)C=C)cc3)cc2)cc1.C=CC(=O)OCCc1ccc(OC(=O)c2ccc(-c3ccc(OC(=O)C(=C)C)cc3)cc2)cc1.C=CC(=O)OCCc1ccc(OC(=O)c2ccc(-c3ccc(OC(=O)C=C)cc3)cc2)cc1.C=CC(=O)Oc1ccc(-c2ccc(COc3ccc(CCCOC(=O)C(=C)C)cc3)cc2)cc1.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.

What is the InChIKey of ethane;2-[4-[[4-[4-(2-methylprop-2-enoyloxy)phenyl]phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;[4-[3-(2-methylprop-2-enoyloxy)propyl]phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-(4-prop-2-enoyloxyphenyl)benzoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl prop-2-enoate;[4-[4-[[4-(3-prop-2-enoyloxypropyl)phenoxy]methyl]phenyl]phenyl] 2-methylprop-2-enoate?

The InChIKey is MODWFCWLJUZWSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H28O6.C30H30O5.2C29H28O5.C28H24O6.C28H26O5.C27H22O6.21C2H6/c1-20(2)28(31)34-19-5-6-22-7-15-26(16-8-22)36-30(33)25-11-9-23(10-12-25)24-13-17-27(18-14-24)35-29(32)21(3)4;1-20(2)29(31)34-18-22(5)24-10-14-27(15-11-24)33-19-23-6-8-25(9-7-23)26-12-16-28(17-13-26)35-30(32)21(3)4;1-4-28(30)34-27-17-13-25(14-18-27)24-11-7-23(8-12-24)20-33-26-15-9-22(10-16-26)6-5-19-32-29(31)21(2)3;1-4-28(30)32-19-5-6-22-9-15-26(16-10-22)33-20-23-7-11-24(12-8-23)25-13-17-27(18-14-25)34-29(31)21(2)3;1-4-26(29)32-18-17-20-5-13-24(14-6-20)34-28(31)23-9-7-21(8-10-23)22-11-15-25(16-12-22)33-27(30)19(2)3;1-3-27(29)31-19-5-6-21-9-15-25(16-10-21)32-20-22-7-11-23(12-8-22)24-13-17-26(18-14-24)33-28(30)4-2;1-3-25(28)31-18-17-19-5-13-24(14-6-19)33-27(30)22-9-7-20(8-10-22)21-11-15-23(16-12-21)32-26(29)4-2;21*1-2/h7-18H,1,3,5-6,19H2,2,4H3;6-17,22H,1,3,18-19H2,2,4-5H3;2*4,7-18H,1-2,5-6,19-20H2,3H3;4-16H,1-2,17-18H2,3H3;3-4,7-18H,1-2,5-6,19-20H2;3-16H,1-2,17-18H2;21*1-2H3.

What are the key properties of ethane;2-[4-[[4-[4-(2-methylprop-2-enoyloxy)phenyl]phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;[4-[3-(2-methylprop-2-enoyloxy)propyl]phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-(4-prop-2-enoyloxyphenyl)benzoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl prop-2-enoate;[4-[4-[[4-(3-prop-2-enoyloxypropyl)phenoxy]methyl]phenyl]phenyl] 2-methylprop-2-enoate?

ethane;2-[4-[[4-[4-(2-methylprop-2-enoyloxy)phenyl]phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;[4-[3-(2-methylprop-2-enoyloxy)propyl]phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-(4-prop-2-enoyloxyphenyl)benzoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl prop-2-enoate;[4-[4-[[4-(3-prop-2-enoyloxypropyl)phenoxy]methyl]phenyl]phenyl] 2-methylprop-2-enoate has a molecular weight of 3841.13 g/mol, XLogP of 62.39, 71 rotatable bonds, 0 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for ethane;2-[4-[[4-[4-(2-methylprop-2-enoyloxy)phenyl]phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;[4-[3-(2-methylprop-2-enoyloxy)propyl]phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzoate;[4-(2-prop-2-enoyloxyethyl)phenyl] 4-(4-prop-2-enoyloxyphenyl)benzoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl 2-methylprop-2-enoate;3-[4-[[4-(4-prop-2-enoyloxyphenyl)phenyl]methoxy]phenyl]propyl prop-2-enoate;[4-[4-[[4-(3-prop-2-enoyloxypropyl)phenoxy]methyl]phenyl]phenyl] 2-methylprop-2-enoate is sourced from PubChem (CID 159623252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).