5-[1,1,1,3,3,3-hexafluoro-2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-4,7-dimethyl-3-phenyl-3H-1-benzofuran-2-one;7-methyl-5-[2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-3-phenyl-3H-1-benzofuran-2-one;5-[(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)methyl]-3-phenyl-3H-1-benzofuran-2-one

C96H72F6O12 — CID 90847500

IUPAC5-[1,1,1,3,3,3-hexafluoro-2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-4,7-dimethyl-3-phenyl-3H-1-benzofuran-2-one;7-methyl-5-[2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-3-phenyl-3H-1-benzofuran-2-one;5-[(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)methyl]-3-phenyl-3H-1-benzofuran-2-one
SMILESCc1cc(C(C)(C)c2cc(C)c3c(c2)C(c2ccccc2)C(=O)O3)cc2c1OC(=O)C2c1ccccc1.Cc1cc(C(c2cc(C)c3c(c2C)C(c2ccccc2)C(=O)O3)(C(F)(F)F)C(F)(F)F)cc2c1OC(=O)C2c1ccccc1.O=C1Oc2ccc(Cc3ccc4c(c3)C(c3ccccc3)C(=O)O4)cc2C1c1ccccc1
InChIInChI=1S/C34H24F6O4.C33H28O4.C29H20O4/c1-17-14-22(16-23-26(30(41)43-28(17)23)20-10-6-4-7-11-20)32(33(35,36)37,34(38,39)40)24-15-18(2)29-25(19(24)3)27(31(42)44-29)21-12-8-5-9-13-21;1-19-15-23(17-25-27(31(34)36-29(19)25)21-11-7-5-8-12-21)33(3,4)24-16-20(2)30-26(18-24)28(32(35)37-30)22-13-9-6-10-14-22;30-28-26(20-7-3-1-4-8-20)22-16-18(11-13-24(22)32-28)15-19-12-14-25-23(17-19)27(29(31)33-25)21-9-5-2-6-10-21/h4-16,26-27H,1-3H3;5-18,27-28H,1-4H3;1-14,16-17,26-27H,15H2
InChIKeyDRORNTPEHOEDGP-UHFFFAOYSA-N
MW1531.61 g/mol
LogP20.23
Rot. Bonds12

About 5-[1,1,1,3,3,3-hexafluoro-2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-4,7-dimethyl-3-phenyl-3H-1-benzofuran-2-one;7-methyl-5-[2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-3-phenyl-3H-1-benzofuran-2-one;5-[(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)methyl]-3-phenyl-3H-1-benzofuran-2-one

5-[1,1,1,3,3,3-hexafluoro-2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-4,7-dimethyl-3-phenyl-3H-1-benzofuran-2-one;7-methyl-5-[2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-3-phenyl-3H-1-benzofuran-2-one;5-[(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)methyl]-3-phenyl-3H-1-benzofuran-2-one (PubChem CID 90847500) has the molecular formula C96H72F6O12 and a molecular weight of 1531.61 g/mol. Its IUPAC name is 5-[1,1,1,3,3,3-hexafluoro-2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-4,7-dimethyl-3-phenyl-3H-1-benzofuran-2-one;7-methyl-5-[2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-3-phenyl-3H-1-benzofuran-2-one;5-[(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)methyl]-3-phenyl-3H-1-benzofuran-2-one.

Molecular Properties

Compound Name5-[1,1,1,3,3,3-hexafluoro-2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-4,7-dimethyl-3-phenyl-3H-1-benzofuran-2-one;7-methyl-5-[2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-3-phenyl-3H-1-benzofuran-2-one;5-[(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)methyl]-3-phenyl-3H-1-benzofuran-2-one
PubChem CID90847500
Molecular FormulaC96H72F6O12
Molecular Weight1531.61 g/mol
Exact Mass1530.49
IUPAC Name5-[1,1,1,3,3,3-hexafluoro-2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-4,7-dimethyl-3-phenyl-3H-1-benzofuran-2-one;7-methyl-5-[2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-3-phenyl-3H-1-benzofuran-2-one;5-[(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)methyl]-3-phenyl-3H-1-benzofuran-2-one
SMILESCc1cc(C(C)(C)c2cc(C)c3c(c2)C(c2ccccc2)C(=O)O3)cc2c1OC(=O)C2c1ccccc1.Cc1cc(C(c2cc(C)c3c(c2C)C(c2ccccc2)C(=O)O3)(C(F)(F)F)C(F)(F)F)cc2c1OC(=O)C2c1ccccc1.O=C1Oc2ccc(Cc3ccc4c(c3)C(c3ccccc3)C(=O)O4)cc2C1c1ccccc1
InChIInChI=1S/C34H24F6O4.C33H28O4.C29H20O4/c1-17-14-22(16-23-26(30(41)43-28(17)23)20-10-6-4-7-11-20)32(33(35,36)37,34(38,39)40)24-15-18(2)29-25(19(24)3)27(31(42)44-29)21-12-8-5-9-13-21;1-19-15-23(17-25-27(31(34)36-29(19)25)21-11-7-5-8-12-21)33(3,4)24-16-20(2)30-26(18-24)28(32(35)37-30)22-13-9-6-10-14-22;30-28-26(20-7-3-1-4-8-20)22-16-18(11-13-24(22)32-28)15-19-12-14-25-23(17-19)27(29(31)33-25)21-9-5-2-6-10-21/h4-16,26-27H,1-3H3;5-18,27-28H,1-4H3;1-14,16-17,26-27H,15H2
InChIKeyDRORNTPEHOEDGP-UHFFFAOYSA-N
XLogP20.23
TPSA157.80 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds12
Heavy Atoms114
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001531.61
LogP ≤ 520.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

Analyze 5-[1,1,1,3,3,3-hexafluoro-2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-4,7-dimethyl-3-phenyl-3H-1-benzofuran-2-one;7-methyl-5-[2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-3-phenyl-3H-1-benzofuran-2-one;5-[(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)methyl]-3-phenyl-3H-1-benzofuran-2-one with MolForge

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Related Compounds

5-[1,1,1,3,3,3-hexafluoro-2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-4,7-dimethyl-3-phenyl-3H-1-benzofuran-2-one
CID 58982792
5-[2-(1,3-Dioxo-2-benzofuran-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-benzofuran-1,3-dione;5-[(1,3-dioxo-2-benzofuran-5-yl)oxy]-2-benzofuran-1,3-dione
CID 88524927
[4-[4-[bis(4-fluorophenyl)methyl]-3,5-difluorophenyl]phenyl] 2,7-ditert-butyl-9H-fluorene-9-carboxylate
CID 143114590
[3-methyl-4-[5-[(E)-2-(4-prop-2-enoyloxyphenyl)ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-(2-methyl-4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]phenyl] prop-2-enoate;[4-[(E)-2-[5-(4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]-3-(trifluoromethyl)phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-2-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] prop-2-enoate
CID 157164437
5-(1,3-dioxo-2-benzofuran-5-carbonyl)-2-benzofuran-1,3-dione;5-[4-[[4-[(1,3-dioxo-2-benzofuran-5-yl)oxy]phenyl]-difluoromethyl]phenoxy]-2-benzofuran-1,3-dione;5-[4-[2-[4-[(1,3-dioxo-2-benzofuran-5-yl)oxy]phenyl]propan-2-yl]phenoxy]-2-benzofuran-1,3-dione;3-[(2Z,6E,12E,15E,17E)-15-[2-(2,5-dioxooxolan-3-yl)ethylidene]-9-ethenyl-3-propylicosa-2,6,12,17-tetraenyl]oxolane-2,5-dione;3-[(2E,4E)-6-(2,5-dioxooxolan-3-yl)hexa-2,4-dienyl]furan-2,5-dione;6-(2,5-dioxooxolan-3-yl)-7-methyl-3a,4,5,7a-tetrahydro-2-benzofuran-1,3-dione;furo[3,4-f][2]benzofuran-1,3,5,7-tetrone
CID 157242967
acenaphthylene-3-carboxylic acid;acenaphthylene-4-carboxylic acid;acenaphthylene-5-carboxylic acid;acenaphthylen-3-yl acetate;acenaphthylen-4-yl acetate;acenaphthylen-5-yl acetate;acenaphthylen-3-yl 2,2,2-trifluoroacetate;acenaphthylen-4-yl 2,2,2-trifluoroacetate;acenaphthylen-5-yl 2,2,2-trifluoroacetate;1H-indene;methyl acenaphthylene-3-carboxylate;methyl acenaphthylene-4-carboxylate;methyl acenaphthylene-5-carboxylate;4-methyl-1H-indene;5-methyl-1H-indene;6-methyl-1H-indene
CID 157337752
5-[1,1,1,3,3,3-hexafluoro-2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-4,7-dimethyl-3-phenyl-3H-1-benzofuran-2-one;5-[1-(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)cyclohexyl]-3-phenyl-3H-1-benzofuran-2-one;5-[9-(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)fluoren-9-yl]-3-phenyl-3H-1-benzofuran-2-one;5-[1-(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)-1-(2-oxo-3-phenyl-1,3-dihydroinden-5-yl)ethyl]-3-phenyl-3H-1-benzofuran-2-one;5-[(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)oxy]-3-phenyl-3H-1-benzofuran-2-one;5-[2-(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-3-phenyl-3H-1-benzofuran-2-one;5-[2-[4-[2-(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]phenyl]propan-2-yl]-3-phenyl-3H-1-benzofuran-2-one
CID 157352980
5-(1,3-dioxo-2-benzofuran-5-carbonyl)-2-benzofuran-1,3-dione;5-[(1,3-dioxo-2-benzofuran-5-yl)-difluoromethyl]-2-benzofuran-1,3-dione;5-[4-[[4-[(1,3-dioxo-2-benzofuran-5-yl)oxy]phenyl]-difluoromethyl]phenoxy]-2-benzofuran-1,3-dione;5-[4-[2-[4-[(1,3-dioxo-2-benzofuran-5-yl)oxy]phenyl]propan-2-yl]phenoxy]-2-benzofuran-1,3-dione;3-[(2E,4E)-6-(2,4-dioxocyclopentyl)hexa-2,4-dienyl]oxolane-2,5-dione;5-(2,5-dioxooxolan-3-yl)-4-methyl-2-benzofuran-1,3-dione;molecular fluorine
CID 157486129
5-[1,1,1,3,3,3-hexafluoro-2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-4,7-dimethyl-3-phenyl-3H-1-benzofuran-2-one;bis(7-methyl-5-[2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-3-phenyl-3H-1-benzofuran-2-one);7-methyl-5-[2-(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-3-phenyl-3H-1-benzofuran-2-one;5-(2-oxo-3-phenyl-3H-1-benzofuran-5-carbonyl)-3-phenyl-3H-1-benzofuran-2-one;5-[1-(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)cyclohexyl]-3-phenyl-3H-1-benzofuran-2-one;5-[1-(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)ethyl]-3-phenyl-3H-1-benzofuran-2-one;5-[(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)methyl]-3-phenyl-3H-1-benzofuran-2-one;5-[1-(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)-1-phenylethyl]-3-phenyl-3H-1-benzofuran-2-one;9,12,14,20-tetramethyl-5,16-diphenyl-7,18-dioxapentacyclo[11.7.0.03,11.04,8.015,19]icosa-1(20),3(11),4(8),9,13,15(19)-hexaene-6,17-dione
CID 157490197
5-[2-(1,3-Dioxo-3a,4,5,6,7,7a-hexahydro-2-benzofuran-5-yl)ethyl]-3a,4,5,6,7,7a-hexahydro-2-benzofuran-1,3-dione;5-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydro-2-benzofuran-5-yl)ethyl]-2-benzofuran-1,3-dione;5-[(1,3-dioxo-3a,4,5,6,7,7a-hexahydro-2-benzofuran-5-yl)oxy]-3a,4,5,6,7,7a-hexahydro-2-benzofuran-1,3-dione;5-[(1,3-dioxo-3a,4,5,6,7,7a-hexahydro-2-benzofuran-5-yl)oxy]-2-benzofuran-1,3-dione;5-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydro-2-benzofuran-5-yl)-1,1,1-trifluoropropan-2-yl]-3a,4,5,6,7,7a-hexahydro-2-benzofuran-1,3-dione;5-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydro-2-benzofuran-5-yl)-1,1,1-trifluoropropan-2-yl]-2-benzofuran-1,3-dione;bis(5-[(1,3-dioxo-2-benzofuran-5-yl)methyl]-2-benzofuran-1,3-dione);5-[2-(1,3-dioxo-2-benzofuran-5-yl)propan-2-yl]-2-benzofuran-1,3-dione;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1-trifluoropropan-2-yl]-2-benzofuran-1,3-dione
CID 157520806
1-(4-ethoxycyclohexyl)-2-fluoro-4-[(E)-2-(4-methylcyclohexyl)ethenyl]-3-(trifluoromethyl)benzene;1-ethoxy-2-fluoro-4-[(E)-2-[4-[2-(4-propylcyclohexyl)ethyl]cyclohexyl]ethenyl]-3-(trifluoromethyl)benzene;1-ethoxy-2-fluoro-4-[(E)-2-[4-[(4-propylcyclohexyl)methoxy]cyclohexyl]ethenyl]-3-(trifluoromethyl)benzene;[4-[(E)-2-[4-ethoxy-3-fluoro-2-(trifluoromethyl)phenyl]ethenyl]cyclohexyl] 4-methylcyclohexane-1-carboxylate;1-[(E)-2-(4-ethylcyclohexyl)ethenyl]-3-fluoro-4-[(4-propylcyclohexyl)methoxy]-2-(trifluoromethyl)benzene;1-(4-ethylcyclohexyl)-2-fluoro-4-[(E)-2-(4-propylcyclohexyl)ethenyl]-3-(trifluoromethyl)benzene;2-fluoro-1-[2-(4-methylcyclohexyl)ethyl]-4-[(E)-2-(4-pentylcyclohexyl)ethenyl]-3-(trifluoromethyl)benzene;2-fluoro-1-methyl-4-[(E)-2-[4-(4-propylcyclohexyl)cyclohexyl]ethenyl]-3-(trifluoromethyl)benzene
CID 157524143
[4-(1,3-Dioxo-2-benzofuran-5-carbonyl)oxyphenyl] 1,3-dioxo-2-benzofuran-5-carboxylate;5-[4-[9-[4-[(1,3-dioxo-2-benzofuran-5-yl)oxy]phenyl]fluoren-9-yl]phenoxy]-2-benzofuran-1,3-dione;5-[4-[2-[4-[(1,3-dioxo-2-benzofuran-5-yl)oxy]phenyl]propan-2-yl]phenoxy]-2-benzofuran-1,3-dione;5-[4-[2-[4-[(1,3-dioxo-2-benzofuran-5-yl)oxy]phenyl]-1,1,1-trifluoropropan-2-yl]phenoxy]-2-benzofuran-1,3-dione
CID 157674664

Frequently Asked Questions

What is the IUPAC name of 5-[1,1,1,3,3,3-hexafluoro-2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-4,7-dimethyl-3-phenyl-3H-1-benzofuran-2-one;7-methyl-5-[2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-3-phenyl-3H-1-benzofuran-2-one;5-[(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)methyl]-3-phenyl-3H-1-benzofuran-2-one?
The IUPAC name of 5-[1,1,1,3,3,3-hexafluoro-2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-4,7-dimethyl-3-phenyl-3H-1-benzofuran-2-one;7-methyl-5-[2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-3-phenyl-3H-1-benzofuran-2-one;5-[(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)methyl]-3-phenyl-3H-1-benzofuran-2-one (CID 90847500) is 5-[1,1,1,3,3,3-hexafluoro-2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-4,7-dimethyl-3-phenyl-3H-1-benzofuran-2-one;7-methyl-5-[2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-3-phenyl-3H-1-benzofuran-2-one;5-[(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)methyl]-3-phenyl-3H-1-benzofuran-2-one.
What is the SMILES notation for 5-[1,1,1,3,3,3-hexafluoro-2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-4,7-dimethyl-3-phenyl-3H-1-benzofuran-2-one;7-methyl-5-[2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-3-phenyl-3H-1-benzofuran-2-one;5-[(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)methyl]-3-phenyl-3H-1-benzofuran-2-one?
The canonical SMILES for 5-[1,1,1,3,3,3-hexafluoro-2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-4,7-dimethyl-3-phenyl-3H-1-benzofuran-2-one;7-methyl-5-[2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-3-phenyl-3H-1-benzofuran-2-one;5-[(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)methyl]-3-phenyl-3H-1-benzofuran-2-one is Cc1cc(C(C)(C)c2cc(C)c3c(c2)C(c2ccccc2)C(=O)O3)cc2c1OC(=O)C2c1ccccc1.Cc1cc(C(c2cc(C)c3c(c2C)C(c2ccccc2)C(=O)O3)(C(F)(F)F)C(F)(F)F)cc2c1OC(=O)C2c1ccccc1.O=C1Oc2ccc(Cc3ccc4c(c3)C(c3ccccc3)C(=O)O4)cc2C1c1ccccc1.
What is the InChIKey of 5-[1,1,1,3,3,3-hexafluoro-2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-4,7-dimethyl-3-phenyl-3H-1-benzofuran-2-one;7-methyl-5-[2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-3-phenyl-3H-1-benzofuran-2-one;5-[(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)methyl]-3-phenyl-3H-1-benzofuran-2-one?
The InChIKey is DRORNTPEHOEDGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H24F6O4.C33H28O4.C29H20O4/c1-17-14-22(16-23-26(30(41)43-28(17)23)20-10-6-4-7-11-20)32(33(35,36)37,34(38,39)40)24-15-18(2)29-25(19(24)3)27(31(42)44-29)21-12-8-5-9-13-21;1-19-15-23(17-25-27(31(34)36-29(19)25)21-11-7-5-8-12-21)33(3,4)24-16-20(2)30-26(18-24)28(32(35)37-30)22-13-9-6-10-14-22;30-28-26(20-7-3-1-4-8-20)22-16-18(11-13-24(22)32-28)15-19-12-14-25-23(17-19)27(29(31)33-25)21-9-5-2-6-10-21/h4-16,26-27H,1-3H3;5-18,27-28H,1-4H3;1-14,16-17,26-27H,15H2.
What are the key properties of 5-[1,1,1,3,3,3-hexafluoro-2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-4,7-dimethyl-3-phenyl-3H-1-benzofuran-2-one;7-methyl-5-[2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-3-phenyl-3H-1-benzofuran-2-one;5-[(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)methyl]-3-phenyl-3H-1-benzofuran-2-one?
5-[1,1,1,3,3,3-hexafluoro-2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-4,7-dimethyl-3-phenyl-3H-1-benzofuran-2-one;7-methyl-5-[2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-3-phenyl-3H-1-benzofuran-2-one;5-[(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)methyl]-3-phenyl-3H-1-benzofuran-2-one has a molecular weight of 1531.61 g/mol, XLogP of 20.23, 12 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1,1,1,3,3,3-hexafluoro-2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-4,7-dimethyl-3-phenyl-3H-1-benzofuran-2-one;7-methyl-5-[2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-3-phenyl-3H-1-benzofuran-2-one;5-[(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)methyl]-3-phenyl-3H-1-benzofuran-2-one is sourced from PubChem (CID 90847500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).