9,9-bis(6-ethenoxynaphthalen-2-yl)fluorene;9,9-bis(4-ethenoxyphenyl)fluorene;9-(6-ethenoxynaphthalen-2-yl)fluoren-9-ol;6-[9-(6-ethenoxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;(9-hydroxyfluoren-9-yl) prop-2-enoate;(9-prop-2-enoyloxyfluoren-9-yl) prop-2-enoate

C161H116O15 — CID 160540731

IUPAC9,9-bis(6-ethenoxynaphthalen-2-yl)fluorene;9,9-bis(4-ethenoxyphenyl)fluorene;9-(6-ethenoxynaphthalen-2-yl)fluoren-9-ol;6-[9-(6-ethenoxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;(9-hydroxyfluoren-9-yl) prop-2-enoate;(9-prop-2-enoyloxyfluoren-9-yl) prop-2-enoate
SMILESC=CC(=O)OC1(O)c2ccccc2-c2ccccc21.C=CC(=O)OC1(OC(=O)C=C)c2ccccc2-c2ccccc21.C=COc1ccc(C2(c3ccc(OC=C)cc3)c3ccccc3-c3ccccc32)cc1.C=COc1ccc2cc(C3(O)c4ccccc4-c4ccccc43)ccc2c1.C=COc1ccc2cc(C3(c4ccc5cc(O)ccc5c4)c4ccccc4-c4ccccc43)ccc2c1.C=COc1ccc2cc(C3(c4ccc5cc(OC=C)ccc5c4)c4ccccc4-c4ccccc43)ccc2c1
InChIInChI=1S/C37H26O2.C35H24O2.C29H22O2.C25H18O2.C19H14O4.C16H12O3/c1-3-38-31-19-15-25-21-29(17-13-27(25)23-31)37(30-18-14-28-24-32(39-4-2)20-16-26(28)22-30)35-11-7-5-9-33(35)34-10-6-8-12-36(34)37;1-2-37-30-18-14-24-20-28(16-12-26(24)22-30)35(27-15-11-25-21-29(36)17-13-23(25)19-27)33-9-5-3-7-31(33)32-8-4-6-10-34(32)35;1-3-30-23-17-13-21(14-18-23)29(22-15-19-24(20-16-22)31-4-2)27-11-7-5-9-25(27)26-10-6-8-12-28(26)29;1-2-27-20-14-12-17-15-19(13-11-18(17)16-20)25(26)23-9-5-3-7-21(23)22-8-4-6-10-24(22)25;1-3-17(20)22-19(23-18(21)4-2)15-11-7-5-9-13(15)14-10-6-8-12-16(14)19;1-2-15(17)19-16(18)13-9-5-3-7-11(13)12-8-4-6-10-14(12)16/h3-24H,1-2H2;2-22,36H,1H2;3-20H,1-2H2;2-16,26H,1H2;3-12H,1-2H2;2-10,18H,1H2
InChIKeyQWTBUJFJLWSMJC-UHFFFAOYSA-N
MW2290.68 g/mol
LogP36.62
Rot. Bonds25

About 9,9-bis(6-ethenoxynaphthalen-2-yl)fluorene;9,9-bis(4-ethenoxyphenyl)fluorene;9-(6-ethenoxynaphthalen-2-yl)fluoren-9-ol;6-[9-(6-ethenoxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;(9-hydroxyfluoren-9-yl) prop-2-enoate;(9-prop-2-enoyloxyfluoren-9-yl) prop-2-enoate

9,9-bis(6-ethenoxynaphthalen-2-yl)fluorene;9,9-bis(4-ethenoxyphenyl)fluorene;9-(6-ethenoxynaphthalen-2-yl)fluoren-9-ol;6-[9-(6-ethenoxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;(9-hydroxyfluoren-9-yl) prop-2-enoate;(9-prop-2-enoyloxyfluoren-9-yl) prop-2-enoate (PubChem CID 160540731) has the molecular formula C161H116O15 and a molecular weight of 2290.68 g/mol. Its IUPAC name is 9,9-bis(6-ethenoxynaphthalen-2-yl)fluorene;9,9-bis(4-ethenoxyphenyl)fluorene;9-(6-ethenoxynaphthalen-2-yl)fluoren-9-ol;6-[9-(6-ethenoxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;(9-hydroxyfluoren-9-yl) prop-2-enoate;(9-prop-2-enoyloxyfluoren-9-yl) prop-2-enoate.

Molecular Properties

Compound Name9,9-bis(6-ethenoxynaphthalen-2-yl)fluorene;9,9-bis(4-ethenoxyphenyl)fluorene;9-(6-ethenoxynaphthalen-2-yl)fluoren-9-ol;6-[9-(6-ethenoxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;(9-hydroxyfluoren-9-yl) prop-2-enoate;(9-prop-2-enoyloxyfluoren-9-yl) prop-2-enoate
PubChem CID160540731
Molecular FormulaC161H116O15
Molecular Weight2290.68 g/mol
Exact Mass2288.83
IUPAC Name9,9-bis(6-ethenoxynaphthalen-2-yl)fluorene;9,9-bis(4-ethenoxyphenyl)fluorene;9-(6-ethenoxynaphthalen-2-yl)fluoren-9-ol;6-[9-(6-ethenoxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;(9-hydroxyfluoren-9-yl) prop-2-enoate;(9-prop-2-enoyloxyfluoren-9-yl) prop-2-enoate
SMILESC=CC(=O)OC1(O)c2ccccc2-c2ccccc21.C=CC(=O)OC1(OC(=O)C=C)c2ccccc2-c2ccccc21.C=COc1ccc(C2(c3ccc(OC=C)cc3)c3ccccc3-c3ccccc32)cc1.C=COc1ccc2cc(C3(O)c4ccccc4-c4ccccc43)ccc2c1.C=COc1ccc2cc(C3(c4ccc5cc(O)ccc5c4)c4ccccc4-c4ccccc43)ccc2c1.C=COc1ccc2cc(C3(c4ccc5cc(OC=C)ccc5c4)c4ccccc4-c4ccccc43)ccc2c1
InChIInChI=1S/C37H26O2.C35H24O2.C29H22O2.C25H18O2.C19H14O4.C16H12O3/c1-3-38-31-19-15-25-21-29(17-13-27(25)23-31)37(30-18-14-28-24-32(39-4-2)20-16-26(28)22-30)35-11-7-5-9-33(35)34-10-6-8-12-36(34)37;1-2-37-30-18-14-24-20-28(16-12-26(24)22-30)35(27-15-11-25-21-29(36)17-13-23(25)19-27)33-9-5-3-7-31(33)32-8-4-6-10-34(32)35;1-3-30-23-17-13-21(14-18-23)29(22-15-19-24(20-16-22)31-4-2)27-11-7-5-9-25(27)26-10-6-8-12-28(26)29;1-2-27-20-14-12-17-15-19(13-11-18(17)16-20)25(26)23-9-5-3-7-21(23)22-8-4-6-10-24(22)25;1-3-17(20)22-19(23-18(21)4-2)15-11-7-5-9-13(15)14-10-6-8-12-16(14)19;1-2-15(17)19-16(18)13-9-5-3-7-11(13)12-8-4-6-10-14(12)16/h3-24H,1-2H2;2-22,36H,1H2;3-20H,1-2H2;2-16,26H,1H2;3-12H,1-2H2;2-10,18H,1H2
InChIKeyQWTBUJFJLWSMJC-UHFFFAOYSA-N
XLogP36.62
TPSA194.97 Ų
H-Bond Donors3
H-Bond Acceptors15
Rotatable Bonds25
Heavy Atoms176
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002290.68
LogP ≤ 536.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze 9,9-bis(6-ethenoxynaphthalen-2-yl)fluorene;9,9-bis(4-ethenoxyphenyl)fluorene;9-(6-ethenoxynaphthalen-2-yl)fluoren-9-ol;6-[9-(6-ethenoxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;(9-hydroxyfluoren-9-yl) prop-2-enoate;(9-prop-2-enoyloxyfluoren-9-yl) prop-2-enoate with MolForge

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Related Compounds

[4-[9-(4-hydroxyphenyl)fluoren-9-yl]phenyl] prop-2-enoate
CID 89273761
6-[9-(6-methoxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol
CID 146804332
11,11-bis(6-ethenoxynaphthalen-2-yl)benzo[b]fluorene;7,7-bis(6-ethenoxynaphthalen-2-yl)benzo[c]fluorene;9,9-bis(6-ethenoxynaphthalen-2-yl)fluorene;12,12-bis(6-ethenoxynaphthalen-2-yl)pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12,12-bis(6-ethenoxynaphthalen-2-yl)pentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;9,9-bis(4-ethenoxyphenyl)fluorene
CID 157208087
[4-[9-(4-methoxyphenyl)fluoren-9-yl]phenyl] prop-2-enoate
CID 155279972
4-[9-[4-[6,12-bis(4-hydroxyphenyl)-12-[4-[9-(4-hydroxyphenyl)fluoren-9-yl]phenyl]indeno[1,2-b]fluoren-6-yl]phenyl]fluoren-9-yl]phenol;6,6,12,12-tetrakis(6-ethenoxynaphthalen-2-yl)indeno[1,2-b]fluorene;6,6,12,12-tetrakis(6-prop-1-en-2-yloxynaphthalen-2-yl)indeno[1,2-b]fluorene;6,6,12,12-tetrakis(6-prop-2-ynoxynaphthalen-2-yl)indeno[1,2-b]fluorene
CID 158750184
6-[9-[6-[4-[6-[9-(6-hydroxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-yl]oxybutoxy]naphthalen-2-yl]fluoren-9-yl]naphthalen-2-ol;2-[9-[6-[4-[6-[9-(2-hydroxy-4-octoxyphenyl)fluoren-9-yl]naphthalen-2-yl]oxybutoxy]naphthalen-2-yl]fluoren-9-yl]-5-octoxyphenol
CID 161116594
6-[9,18,18,27,27-pentakis(6-hydroxynaphthalen-2-yl)-9-heptacyclo[18.7.0.02,10.03,8.011,19.012,17.021,26]heptacosa-1(20),2(10),3,5,7,11(19),12,14,16,21,23,25-dodecaenyl]naphthalen-2-ol
CID 89491369
6-[12-(6-hydroxynaphthalen-2-yl)-6H-indeno[1,2-b]fluoren-12-yl]naphthalen-2-ol
CID 126481591
6-[9-(6-hydroxynaphthalen-2-yl)-3,6-dinaphthalen-2-ylfluoren-9-yl]naphthalen-2-ol
CID 153407946
6-[18,27-bis(6-hydroxynaphthalen-2-yl)-9,18,27-trinaphthalen-2-yl-9-heptacyclo[18.7.0.02,10.03,8.011,19.012,17.021,26]heptacosa-1,3,5,7,10,12,14,16,19,21,23,25-dodecaenyl]naphthalen-2-ol
CID 89491411
10,10-bis(6-ethenoxynaphthalen-2-yl)-9H-anthracene;11,11-bis(4-ethenoxyphenyl)benzo[a]fluorene;12,12-bis(4-ethenoxyphenyl)pentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12,12-bis(4-ethenoxyphenyl)pentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaene;12,12-bis(4-ethenoxyphenyl)pentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaene;12,12-bis(4-ethenoxyphenyl)pentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene
CID 158885777
ethane;6-[9-(6-hydroxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;11-methyl-11H-benzo[b]fluorene
CID 158465473

Frequently Asked Questions

What is the IUPAC name of 9,9-bis(6-ethenoxynaphthalen-2-yl)fluorene;9,9-bis(4-ethenoxyphenyl)fluorene;9-(6-ethenoxynaphthalen-2-yl)fluoren-9-ol;6-[9-(6-ethenoxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;(9-hydroxyfluoren-9-yl) prop-2-enoate;(9-prop-2-enoyloxyfluoren-9-yl) prop-2-enoate?
The IUPAC name of 9,9-bis(6-ethenoxynaphthalen-2-yl)fluorene;9,9-bis(4-ethenoxyphenyl)fluorene;9-(6-ethenoxynaphthalen-2-yl)fluoren-9-ol;6-[9-(6-ethenoxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;(9-hydroxyfluoren-9-yl) prop-2-enoate;(9-prop-2-enoyloxyfluoren-9-yl) prop-2-enoate (CID 160540731) is 9,9-bis(6-ethenoxynaphthalen-2-yl)fluorene;9,9-bis(4-ethenoxyphenyl)fluorene;9-(6-ethenoxynaphthalen-2-yl)fluoren-9-ol;6-[9-(6-ethenoxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;(9-hydroxyfluoren-9-yl) prop-2-enoate;(9-prop-2-enoyloxyfluoren-9-yl) prop-2-enoate.
What is the SMILES notation for 9,9-bis(6-ethenoxynaphthalen-2-yl)fluorene;9,9-bis(4-ethenoxyphenyl)fluorene;9-(6-ethenoxynaphthalen-2-yl)fluoren-9-ol;6-[9-(6-ethenoxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;(9-hydroxyfluoren-9-yl) prop-2-enoate;(9-prop-2-enoyloxyfluoren-9-yl) prop-2-enoate?
The canonical SMILES for 9,9-bis(6-ethenoxynaphthalen-2-yl)fluorene;9,9-bis(4-ethenoxyphenyl)fluorene;9-(6-ethenoxynaphthalen-2-yl)fluoren-9-ol;6-[9-(6-ethenoxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;(9-hydroxyfluoren-9-yl) prop-2-enoate;(9-prop-2-enoyloxyfluoren-9-yl) prop-2-enoate is C=CC(=O)OC1(O)c2ccccc2-c2ccccc21.C=CC(=O)OC1(OC(=O)C=C)c2ccccc2-c2ccccc21.C=COc1ccc(C2(c3ccc(OC=C)cc3)c3ccccc3-c3ccccc32)cc1.C=COc1ccc2cc(C3(O)c4ccccc4-c4ccccc43)ccc2c1.C=COc1ccc2cc(C3(c4ccc5cc(O)ccc5c4)c4ccccc4-c4ccccc43)ccc2c1.C=COc1ccc2cc(C3(c4ccc5cc(OC=C)ccc5c4)c4ccccc4-c4ccccc43)ccc2c1.
What is the InChIKey of 9,9-bis(6-ethenoxynaphthalen-2-yl)fluorene;9,9-bis(4-ethenoxyphenyl)fluorene;9-(6-ethenoxynaphthalen-2-yl)fluoren-9-ol;6-[9-(6-ethenoxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;(9-hydroxyfluoren-9-yl) prop-2-enoate;(9-prop-2-enoyloxyfluoren-9-yl) prop-2-enoate?
The InChIKey is QWTBUJFJLWSMJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H26O2.C35H24O2.C29H22O2.C25H18O2.C19H14O4.C16H12O3/c1-3-38-31-19-15-25-21-29(17-13-27(25)23-31)37(30-18-14-28-24-32(39-4-2)20-16-26(28)22-30)35-11-7-5-9-33(35)34-10-6-8-12-36(34)37;1-2-37-30-18-14-24-20-28(16-12-26(24)22-30)35(27-15-11-25-21-29(36)17-13-23(25)19-27)33-9-5-3-7-31(33)32-8-4-6-10-34(32)35;1-3-30-23-17-13-21(14-18-23)29(22-15-19-24(20-16-22)31-4-2)27-11-7-5-9-25(27)26-10-6-8-12-28(26)29;1-2-27-20-14-12-17-15-19(13-11-18(17)16-20)25(26)23-9-5-3-7-21(23)22-8-4-6-10-24(22)25;1-3-17(20)22-19(23-18(21)4-2)15-11-7-5-9-13(15)14-10-6-8-12-16(14)19;1-2-15(17)19-16(18)13-9-5-3-7-11(13)12-8-4-6-10-14(12)16/h3-24H,1-2H2;2-22,36H,1H2;3-20H,1-2H2;2-16,26H,1H2;3-12H,1-2H2;2-10,18H,1H2.
What are the key properties of 9,9-bis(6-ethenoxynaphthalen-2-yl)fluorene;9,9-bis(4-ethenoxyphenyl)fluorene;9-(6-ethenoxynaphthalen-2-yl)fluoren-9-ol;6-[9-(6-ethenoxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;(9-hydroxyfluoren-9-yl) prop-2-enoate;(9-prop-2-enoyloxyfluoren-9-yl) prop-2-enoate?
9,9-bis(6-ethenoxynaphthalen-2-yl)fluorene;9,9-bis(4-ethenoxyphenyl)fluorene;9-(6-ethenoxynaphthalen-2-yl)fluoren-9-ol;6-[9-(6-ethenoxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;(9-hydroxyfluoren-9-yl) prop-2-enoate;(9-prop-2-enoyloxyfluoren-9-yl) prop-2-enoate has a molecular weight of 2290.68 g/mol, XLogP of 36.62, 25 rotatable bonds, 3 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-bis(6-ethenoxynaphthalen-2-yl)fluorene;9,9-bis(4-ethenoxyphenyl)fluorene;9-(6-ethenoxynaphthalen-2-yl)fluoren-9-ol;6-[9-(6-ethenoxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;(9-hydroxyfluoren-9-yl) prop-2-enoate;(9-prop-2-enoyloxyfluoren-9-yl) prop-2-enoate is sourced from PubChem (CID 160540731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).