[6-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl 2-methylprop-2-enoate;[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]methoxymethyl 2-methylprop-2-enoate;[(E)-3-[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoyl]oxymethyl 2-methylprop-2-enoate;2-methylprop-2-enoyloxymethyl 4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]benzoate;[6-[4-(4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl prop-2-enoate;prop-2-enoyloxymethyl 4-[4-(4-oxohex-5-en-1-ynyl)phenyl]benzoate;prop-2-enoyloxymethyl (E)-3-[4-[4-(4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoate

C179H152O32 — CID 161400557

IUPAC[6-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl 2-methylprop-2-enoate;[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]methoxymethyl 2-methylprop-2-enoate;[(E)-3-[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoyl]oxymethyl 2-methylprop-2-enoate;2-methylprop-2-enoyloxymethyl 4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]benzoate;[6-[4-(4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl prop-2-enoate;prop-2-enoyloxymethyl 4-[4-(4-oxohex-5-en-1-ynyl)phenyl]benzoate;prop-2-enoyloxymethyl (E)-3-[4-[4-(4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoate
SMILESC=C(C)C(=O)CC#Cc1ccc(-c2ccc(/C=C/C(=O)OCOC(=O)C(=C)C)cc2)cc1.C=C(C)C(=O)CC#Cc1ccc(-c2ccc(C(=O)OCOC(=O)C(=C)C)cc2)cc1.C=C(C)C(=O)CC#Cc1ccc(-c2ccc(COCOC(=O)C(=C)C)cc2)cc1.C=C(C)C(=O)CC#Cc1ccc(-c2ccc3cc(OCOC(=O)C(=C)C)ccc3c2)cc1.C=CC(=O)CC#Cc1ccc(-c2ccc(/C=C/C(=O)OCOC(=O)C=C)cc2)cc1.C=CC(=O)CC#Cc1ccc(-c2ccc(C(=O)OCOC(=O)C=C)cc2)cc1.C=CC(=O)CC#Cc1ccc(-c2ccc3cc(OCOC(=O)C=C)ccc3c2)cc1
InChIInChI=1S/C28H24O4.C27H24O5.C26H20O4.C25H22O5.C25H20O5.C25H24O4.C23H18O5/c1-19(2)27(29)7-5-6-21-8-10-22(11-9-21)23-12-13-25-17-26(15-14-24(25)16-23)31-18-32-28(30)20(3)4;1-19(2)25(28)7-5-6-21-8-13-23(14-9-21)24-15-10-22(11-16-24)12-17-26(29)31-18-32-27(30)20(3)4;1-3-24(27)7-5-6-19-8-10-20(11-9-19)21-12-13-23-17-25(15-14-22(23)16-21)29-18-30-26(28)4-2;1-17(2)23(26)7-5-6-19-8-10-20(11-9-19)21-12-14-22(15-13-21)25(28)30-16-29-24(27)18(3)4;1-3-23(26)7-5-6-19-8-13-21(14-9-19)22-15-10-20(11-16-22)12-17-25(28)30-18-29-24(27)4-2;1-18(2)24(26)7-5-6-20-8-12-22(13-9-20)23-14-10-21(11-15-23)16-28-17-29-25(27)19(3)4;1-3-21(24)7-5-6-17-8-10-18(11-9-17)19-12-14-20(15-13-19)23(26)28-16-27-22(25)4-2/h2*8-17H,1,3,7,18H2,2,4H3;3-4,8-17H,1-2,7,18H2;8-15H,1,3,7,16H2,2,4H3;3-4,8-17H,1-2,7,18H2;8-15H,1,3,7,16-17H2,2,4H3;3-4,8-15H,1-2,7,16H2/b;17-12+;;;17-12+;;
InChIKeyVUEJPDSWMALXHJ-WQBSLCGUSA-N
MW2815.15 g/mol
LogP32.89
Rot. Bonds52

About [6-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl 2-methylprop-2-enoate;[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]methoxymethyl 2-methylprop-2-enoate;[(E)-3-[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoyl]oxymethyl 2-methylprop-2-enoate;2-methylprop-2-enoyloxymethyl 4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]benzoate;[6-[4-(4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl prop-2-enoate;prop-2-enoyloxymethyl 4-[4-(4-oxohex-5-en-1-ynyl)phenyl]benzoate;prop-2-enoyloxymethyl (E)-3-[4-[4-(4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoate

[6-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl 2-methylprop-2-enoate;[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]methoxymethyl 2-methylprop-2-enoate;[(E)-3-[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoyl]oxymethyl 2-methylprop-2-enoate;2-methylprop-2-enoyloxymethyl 4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]benzoate;[6-[4-(4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl prop-2-enoate;prop-2-enoyloxymethyl 4-[4-(4-oxohex-5-en-1-ynyl)phenyl]benzoate;prop-2-enoyloxymethyl (E)-3-[4-[4-(4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoate (PubChem CID 161400557) has the molecular formula C179H152O32 and a molecular weight of 2815.15 g/mol. Its IUPAC name is [6-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl 2-methylprop-2-enoate;[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]methoxymethyl 2-methylprop-2-enoate;[(E)-3-[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoyl]oxymethyl 2-methylprop-2-enoate;2-methylprop-2-enoyloxymethyl 4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]benzoate;[6-[4-(4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl prop-2-enoate;prop-2-enoyloxymethyl 4-[4-(4-oxohex-5-en-1-ynyl)phenyl]benzoate;prop-2-enoyloxymethyl (E)-3-[4-[4-(4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoate.

Molecular Properties

Compound Name[6-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl 2-methylprop-2-enoate;[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]methoxymethyl 2-methylprop-2-enoate;[(E)-3-[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoyl]oxymethyl 2-methylprop-2-enoate;2-methylprop-2-enoyloxymethyl 4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]benzoate;[6-[4-(4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl prop-2-enoate;prop-2-enoyloxymethyl 4-[4-(4-oxohex-5-en-1-ynyl)phenyl]benzoate;prop-2-enoyloxymethyl (E)-3-[4-[4-(4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoate
PubChem CID161400557
Molecular FormulaC179H152O32
Molecular Weight2815.15 g/mol
Exact Mass2813.03
IUPAC Name[6-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl 2-methylprop-2-enoate;[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]methoxymethyl 2-methylprop-2-enoate;[(E)-3-[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoyl]oxymethyl 2-methylprop-2-enoate;2-methylprop-2-enoyloxymethyl 4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]benzoate;[6-[4-(4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl prop-2-enoate;prop-2-enoyloxymethyl 4-[4-(4-oxohex-5-en-1-ynyl)phenyl]benzoate;prop-2-enoyloxymethyl (E)-3-[4-[4-(4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoate
SMILESC=C(C)C(=O)CC#Cc1ccc(-c2ccc(/C=C/C(=O)OCOC(=O)C(=C)C)cc2)cc1.C=C(C)C(=O)CC#Cc1ccc(-c2ccc(C(=O)OCOC(=O)C(=C)C)cc2)cc1.C=C(C)C(=O)CC#Cc1ccc(-c2ccc(COCOC(=O)C(=C)C)cc2)cc1.C=C(C)C(=O)CC#Cc1ccc(-c2ccc3cc(OCOC(=O)C(=C)C)ccc3c2)cc1.C=CC(=O)CC#Cc1ccc(-c2ccc(/C=C/C(=O)OCOC(=O)C=C)cc2)cc1.C=CC(=O)CC#Cc1ccc(-c2ccc(C(=O)OCOC(=O)C=C)cc2)cc1.C=CC(=O)CC#Cc1ccc(-c2ccc3cc(OCOC(=O)C=C)ccc3c2)cc1
InChIInChI=1S/C28H24O4.C27H24O5.C26H20O4.C25H22O5.C25H20O5.C25H24O4.C23H18O5/c1-19(2)27(29)7-5-6-21-8-10-22(11-9-21)23-12-13-25-17-26(15-14-24(25)16-23)31-18-32-28(30)20(3)4;1-19(2)25(28)7-5-6-21-8-13-23(14-9-21)24-15-10-22(11-16-24)12-17-26(29)31-18-32-27(30)20(3)4;1-3-24(27)7-5-6-19-8-10-20(11-9-19)21-12-13-23-17-25(15-14-22(23)16-21)29-18-30-26(28)4-2;1-17(2)23(26)7-5-6-19-8-10-20(11-9-19)21-12-14-22(15-13-21)25(28)30-16-29-24(27)18(3)4;1-3-23(26)7-5-6-19-8-13-21(14-9-19)22-15-10-20(11-16-22)12-17-25(28)30-18-29-24(27)4-2;1-18(2)24(26)7-5-6-20-8-12-22(13-9-20)23-14-10-21(11-15-23)16-28-17-29-25(27)19(3)4;1-3-21(24)7-5-6-17-8-10-18(11-9-17)19-12-14-20(15-13-19)23(26)28-16-27-22(25)4-2/h2*8-17H,1,3,7,18H2,2,4H3;3-4,8-17H,1-2,7,18H2;8-15H,1,3,7,16H2,2,4H3;3-4,8-17H,1-2,7,18H2;8-15H,1,3,7,16-17H2,2,4H3;3-4,8-15H,1-2,7,16H2/b;17-12+;;;17-12+;;
InChIKeyVUEJPDSWMALXHJ-WQBSLCGUSA-N
XLogP32.89
TPSA436.48 Ų
H-Bond Donors
H-Bond Acceptors32
Rotatable Bonds52
Heavy Atoms211
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002815.15
LogP ≤ 532.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1032

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'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze [6-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl 2-methylprop-2-enoate;[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]methoxymethyl 2-methylprop-2-enoate;[(E)-3-[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoyl]oxymethyl 2-methylprop-2-enoate;2-methylprop-2-enoyloxymethyl 4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]benzoate;[6-[4-(4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl prop-2-enoate;prop-2-enoyloxymethyl 4-[4-(4-oxohex-5-en-1-ynyl)phenyl]benzoate;prop-2-enoyloxymethyl (E)-3-[4-[4-(4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoate with MolForge

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Related Compounds

[6-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl 2-methylprop-2-enoate
CID 58471620
prop-2-enoyloxymethyl (E)-3-[4-[[4-(4-oxohex-5-en-1-ynyl)phenyl]methoxy]phenyl]prop-2-enoate
CID 58471716
[6-[4-(prop-2-enoyloxymethyl)phenyl]naphthalen-2-yl] 4-(2-methylprop-2-enoyloxymethoxy)benzoate
CID 58471467
[4-(2-methylprop-2-enoyloxymethoxy)phenyl] 6-[4-(2-methylprop-2-enoyloxymethoxy)phenyl]naphthalene-2-carboxylate;[4-(2-methylprop-2-enoyloxymethoxy)phenyl] 6-[4-(prop-2-enoyloxymethoxy)phenyl]naphthalene-2-carboxylate;[4-(2-methylprop-2-enoyloxymethyl)phenyl] 6-[4-(2-methylprop-2-enoyloxymethoxy)phenyl]naphthalene-2-carboxylate;[4-(2-methylprop-2-enoyloxymethyl)phenyl] 6-[4-(2-methylprop-2-enoyloxymethyl)phenyl]naphthalene-2-carboxylate;[4-(prop-2-enoyloxymethoxy)phenyl] 6-[4-(prop-2-enoyloxymethoxy)phenyl]naphthalene-2-carboxylate;[4-(prop-2-enoyloxymethyl)phenyl] 6-[4-(2-methylprop-2-enoyloxymethyl)phenyl]naphthalene-2-carboxylate;[4-(prop-2-enoyloxymethyl)phenyl] 6-[4-(prop-2-enoyloxymethyl)phenyl]naphthalene-2-carboxylate
CID 157198874
[2-fluoro-4-[(E)-3-oxo-3-(prop-2-enoyloxymethoxy)prop-1-enyl]phenyl] 4-(4-oxohex-5-en-1-ynyl)benzoate
CID 58471607
[4-(prop-2-enoyloxymethyl)phenyl] 4-[6-(prop-2-enoyloxymethoxy)naphthalen-2-yl]benzoate
CID 58471477
[2-(hydroxymethyl)-4-[6-(2-methylprop-2-enoyloxymethoxy)naphthalen-2-yl]phenyl] 4-(prop-2-enoyloxymethoxy)benzoate
CID 58471412
[2,3-difluoro-4-[6-(2-methylprop-2-enoyloxymethoxy)naphthalen-2-yl]phenyl] 4-(prop-2-enoyloxymethyl)benzoate
CID 58471450
[4-[3-(2-methylprop-2-enoyloxymethoxy)-3-oxopropyl]phenyl] 4-(4-oxohex-5-en-1-ynyl)benzoate
CID 58471622
[4-[4-(prop-2-enoyloxymethoxy)phenyl]phenyl] 4-[2-fluoro-4-(4-oxohex-5-en-1-ynyl)phenyl]benzoate
CID 58471662
[4-[4-[[(E)-3-phenylprop-2-enoyl]oxymethoxy]phenyl]phenoxy]methyl 2-methylprop-2-enoate
CID 20728904
[2,3-dimethyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl] 6-[4-(prop-2-enoyloxymethyl)phenyl]naphthalene-2-carboxylate
CID 58471505

Frequently Asked Questions

What is the IUPAC name of [6-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl 2-methylprop-2-enoate;[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]methoxymethyl 2-methylprop-2-enoate;[(E)-3-[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoyl]oxymethyl 2-methylprop-2-enoate;2-methylprop-2-enoyloxymethyl 4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]benzoate;[6-[4-(4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl prop-2-enoate;prop-2-enoyloxymethyl 4-[4-(4-oxohex-5-en-1-ynyl)phenyl]benzoate;prop-2-enoyloxymethyl (E)-3-[4-[4-(4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoate?
The IUPAC name of [6-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl 2-methylprop-2-enoate;[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]methoxymethyl 2-methylprop-2-enoate;[(E)-3-[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoyl]oxymethyl 2-methylprop-2-enoate;2-methylprop-2-enoyloxymethyl 4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]benzoate;[6-[4-(4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl prop-2-enoate;prop-2-enoyloxymethyl 4-[4-(4-oxohex-5-en-1-ynyl)phenyl]benzoate;prop-2-enoyloxymethyl (E)-3-[4-[4-(4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoate (CID 161400557) is [6-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl 2-methylprop-2-enoate;[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]methoxymethyl 2-methylprop-2-enoate;[(E)-3-[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoyl]oxymethyl 2-methylprop-2-enoate;2-methylprop-2-enoyloxymethyl 4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]benzoate;[6-[4-(4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl prop-2-enoate;prop-2-enoyloxymethyl 4-[4-(4-oxohex-5-en-1-ynyl)phenyl]benzoate;prop-2-enoyloxymethyl (E)-3-[4-[4-(4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoate.
What is the SMILES notation for [6-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl 2-methylprop-2-enoate;[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]methoxymethyl 2-methylprop-2-enoate;[(E)-3-[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoyl]oxymethyl 2-methylprop-2-enoate;2-methylprop-2-enoyloxymethyl 4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]benzoate;[6-[4-(4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl prop-2-enoate;prop-2-enoyloxymethyl 4-[4-(4-oxohex-5-en-1-ynyl)phenyl]benzoate;prop-2-enoyloxymethyl (E)-3-[4-[4-(4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoate?
The canonical SMILES for [6-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl 2-methylprop-2-enoate;[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]methoxymethyl 2-methylprop-2-enoate;[(E)-3-[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoyl]oxymethyl 2-methylprop-2-enoate;2-methylprop-2-enoyloxymethyl 4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]benzoate;[6-[4-(4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl prop-2-enoate;prop-2-enoyloxymethyl 4-[4-(4-oxohex-5-en-1-ynyl)phenyl]benzoate;prop-2-enoyloxymethyl (E)-3-[4-[4-(4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoate is C=C(C)C(=O)CC#Cc1ccc(-c2ccc(/C=C/C(=O)OCOC(=O)C(=C)C)cc2)cc1.C=C(C)C(=O)CC#Cc1ccc(-c2ccc(C(=O)OCOC(=O)C(=C)C)cc2)cc1.C=C(C)C(=O)CC#Cc1ccc(-c2ccc(COCOC(=O)C(=C)C)cc2)cc1.C=C(C)C(=O)CC#Cc1ccc(-c2ccc3cc(OCOC(=O)C(=C)C)ccc3c2)cc1.C=CC(=O)CC#Cc1ccc(-c2ccc(/C=C/C(=O)OCOC(=O)C=C)cc2)cc1.C=CC(=O)CC#Cc1ccc(-c2ccc(C(=O)OCOC(=O)C=C)cc2)cc1.C=CC(=O)CC#Cc1ccc(-c2ccc3cc(OCOC(=O)C=C)ccc3c2)cc1.
What is the InChIKey of [6-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl 2-methylprop-2-enoate;[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]methoxymethyl 2-methylprop-2-enoate;[(E)-3-[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoyl]oxymethyl 2-methylprop-2-enoate;2-methylprop-2-enoyloxymethyl 4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]benzoate;[6-[4-(4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl prop-2-enoate;prop-2-enoyloxymethyl 4-[4-(4-oxohex-5-en-1-ynyl)phenyl]benzoate;prop-2-enoyloxymethyl (E)-3-[4-[4-(4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoate?
The InChIKey is VUEJPDSWMALXHJ-WQBSLCGUSA-N. The full InChI is InChI=1S/C28H24O4.C27H24O5.C26H20O4.C25H22O5.C25H20O5.C25H24O4.C23H18O5/c1-19(2)27(29)7-5-6-21-8-10-22(11-9-21)23-12-13-25-17-26(15-14-24(25)16-23)31-18-32-28(30)20(3)4;1-19(2)25(28)7-5-6-21-8-13-23(14-9-21)24-15-10-22(11-16-24)12-17-26(29)31-18-32-27(30)20(3)4;1-3-24(27)7-5-6-19-8-10-20(11-9-19)21-12-13-23-17-25(15-14-22(23)16-21)29-18-30-26(28)4-2;1-17(2)23(26)7-5-6-19-8-10-20(11-9-19)21-12-14-22(15-13-21)25(28)30-16-29-24(27)18(3)4;1-3-23(26)7-5-6-19-8-13-21(14-9-19)22-15-10-20(11-16-22)12-17-25(28)30-18-29-24(27)4-2;1-18(2)24(26)7-5-6-20-8-12-22(13-9-20)23-14-10-21(11-15-23)16-28-17-29-25(27)19(3)4;1-3-21(24)7-5-6-17-8-10-18(11-9-17)19-12-14-20(15-13-19)23(26)28-16-27-22(25)4-2/h2*8-17H,1,3,7,18H2,2,4H3;3-4,8-17H,1-2,7,18H2;8-15H,1,3,7,16H2,2,4H3;3-4,8-17H,1-2,7,18H2;8-15H,1,3,7,16-17H2,2,4H3;3-4,8-15H,1-2,7,16H2/b;17-12+;;;17-12+;;.
What are the key properties of [6-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl 2-methylprop-2-enoate;[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]methoxymethyl 2-methylprop-2-enoate;[(E)-3-[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoyl]oxymethyl 2-methylprop-2-enoate;2-methylprop-2-enoyloxymethyl 4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]benzoate;[6-[4-(4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl prop-2-enoate;prop-2-enoyloxymethyl 4-[4-(4-oxohex-5-en-1-ynyl)phenyl]benzoate;prop-2-enoyloxymethyl (E)-3-[4-[4-(4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoate?
[6-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl 2-methylprop-2-enoate;[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]methoxymethyl 2-methylprop-2-enoate;[(E)-3-[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoyl]oxymethyl 2-methylprop-2-enoate;2-methylprop-2-enoyloxymethyl 4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]benzoate;[6-[4-(4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl prop-2-enoate;prop-2-enoyloxymethyl 4-[4-(4-oxohex-5-en-1-ynyl)phenyl]benzoate;prop-2-enoyloxymethyl (E)-3-[4-[4-(4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoate has a molecular weight of 2815.15 g/mol, XLogP of 32.89, 52 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl 2-methylprop-2-enoate;[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]methoxymethyl 2-methylprop-2-enoate;[(E)-3-[4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoyl]oxymethyl 2-methylprop-2-enoate;2-methylprop-2-enoyloxymethyl 4-[4-(5-methyl-4-oxohex-5-en-1-ynyl)phenyl]benzoate;[6-[4-(4-oxohex-5-en-1-ynyl)phenyl]naphthalen-2-yl]oxymethyl prop-2-enoate;prop-2-enoyloxymethyl 4-[4-(4-oxohex-5-en-1-ynyl)phenyl]benzoate;prop-2-enoyloxymethyl (E)-3-[4-[4-(4-oxohex-5-en-1-ynyl)phenyl]phenyl]prop-2-enoate is sourced from PubChem (CID 161400557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).