2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;4-methyl-9,9-diphenylfluorene;2-methylfluoranthene;3-methylfluoranthene;7-methylfluoranthene;8-methylfluoranthene;4-methylphenanthrene;2-methyl-9,9'-spirobi[fluorene];3-methyl-9,9'-spirobi[fluorene];4'-methyl-9,9'-spirobi[fluorene];3,6,6,14,14-pentamethyltetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene

C258H194 — CID 157152340

IUPAC2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;4-methyl-9,9-diphenylfluorene;2-methylfluoranthene;3-methylfluoranthene;7-methylfluoranthene;8-methylfluoranthene;4-methylphenanthrene;2-methyl-9,9'-spirobi[fluorene];3-methyl-9,9'-spirobi[fluorene];4'-methyl-9,9'-spirobi[fluorene];3,6,6,14,14-pentamethyltetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene
SMILESCc1cc2c3c(c1)C(C)(C)c1cccc(c1-3)C2(C)C.Cc1cc2c3c(cccc3c1)-c1ccccc1-2.Cc1ccc2c(c1)-c1cccc3cccc-2c13.Cc1ccc2c(c1)-c1ccccc1C2(c1ccccc1)c1ccccc1.Cc1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2ccccc21.Cc1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1-2.Cc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1ccccc1-2.Cc1ccc2c3c(cccc13)-c1ccccc1-2.Cc1cccc2c1-c1cccc3cccc-2c13.Cc1cccc2c1-c1ccccc1C2(c1ccccc1)c1ccccc1.Cc1cccc2c1-c1ccccc1C21c2ccccc2-c2ccccc21.Cc1cccc2ccc3ccccc3c12
InChIInChI=1S/3C26H18.3C26H20.C19H20.4C17H12.C15H12/c1-17-9-8-16-24-25(17)20-12-4-7-15-23(20)26(24)21-13-5-2-10-18(21)19-11-3-6-14-22(19)26;1-17-14-15-25-21(16-17)20-10-4-7-13-24(20)26(25)22-11-5-2-8-18(22)19-9-3-6-12-23(19)26;1-17-14-15-21-20-10-4-7-13-24(20)26(25(21)16-17)22-11-5-2-8-18(22)19-9-3-6-12-23(19)26;1-19-11-10-18-24-25(19)22-16-8-9-17-23(22)26(24,20-12-4-2-5-13-20)21-14-6-3-7-15-21;1-19-16-17-25-23(18-19)22-14-8-9-15-24(22)26(25,20-10-4-2-5-11-20)21-12-6-3-7-13-21;1-19-16-17-23-22-14-8-9-15-24(22)26(25(23)18-19,20-10-4-2-5-11-20)21-12-6-3-7-13-21;1-11-9-14-17-15(10-11)19(4,5)13-8-6-7-12(16(13)17)18(14,2)3;1-11-5-2-8-13-14-9-3-6-12-7-4-10-15(16(11)13)17(12)14;1-11-8-9-13-14-6-2-4-12-5-3-7-15(17(12)14)16(13)10-11;1-11-9-12-5-4-8-15-13-6-2-3-7-14(13)16(10-11)17(12)15;1-11-9-10-16-14-6-3-2-5-13(14)15-8-4-7-12(11)17(15)16;1-11-5-4-7-13-10-9-12-6-2-3-8-14(12)15(11)13/h3*2-16H,1H3;3*2-18H,1H3;6-10H,1-5H3;4*2-10H,1H3;2-10H,1H3
InChIKeyALKCRFWWLFAVQF-UHFFFAOYSA-N
MW3294.39 g/mol
LogP66.51
Rot. Bonds6

About 2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;4-methyl-9,9-diphenylfluorene;2-methylfluoranthene;3-methylfluoranthene;7-methylfluoranthene;8-methylfluoranthene;4-methylphenanthrene;2-methyl-9,9'-spirobi[fluorene];3-methyl-9,9'-spirobi[fluorene];4'-methyl-9,9'-spirobi[fluorene];3,6,6,14,14-pentamethyltetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene

2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;4-methyl-9,9-diphenylfluorene;2-methylfluoranthene;3-methylfluoranthene;7-methylfluoranthene;8-methylfluoranthene;4-methylphenanthrene;2-methyl-9,9'-spirobi[fluorene];3-methyl-9,9'-spirobi[fluorene];4'-methyl-9,9'-spirobi[fluorene];3,6,6,14,14-pentamethyltetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene (PubChem CID 157152340) has the molecular formula C258H194 and a molecular weight of 3294.39 g/mol. Its IUPAC name is 2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;4-methyl-9,9-diphenylfluorene;2-methylfluoranthene;3-methylfluoranthene;7-methylfluoranthene;8-methylfluoranthene;4-methylphenanthrene;2-methyl-9,9'-spirobi[fluorene];3-methyl-9,9'-spirobi[fluorene];4'-methyl-9,9'-spirobi[fluorene];3,6,6,14,14-pentamethyltetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene.

Molecular Properties

Compound Name2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;4-methyl-9,9-diphenylfluorene;2-methylfluoranthene;3-methylfluoranthene;7-methylfluoranthene;8-methylfluoranthene;4-methylphenanthrene;2-methyl-9,9'-spirobi[fluorene];3-methyl-9,9'-spirobi[fluorene];4'-methyl-9,9'-spirobi[fluorene];3,6,6,14,14-pentamethyltetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene
PubChem CID157152340
Molecular FormulaC258H194
Molecular Weight3294.39 g/mol
Exact Mass3291.52
IUPAC Name2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;4-methyl-9,9-diphenylfluorene;2-methylfluoranthene;3-methylfluoranthene;7-methylfluoranthene;8-methylfluoranthene;4-methylphenanthrene;2-methyl-9,9'-spirobi[fluorene];3-methyl-9,9'-spirobi[fluorene];4'-methyl-9,9'-spirobi[fluorene];3,6,6,14,14-pentamethyltetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene
SMILESCc1cc2c3c(c1)C(C)(C)c1cccc(c1-3)C2(C)C.Cc1cc2c3c(cccc3c1)-c1ccccc1-2.Cc1ccc2c(c1)-c1cccc3cccc-2c13.Cc1ccc2c(c1)-c1ccccc1C2(c1ccccc1)c1ccccc1.Cc1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2ccccc21.Cc1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1-2.Cc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1ccccc1-2.Cc1ccc2c3c(cccc13)-c1ccccc1-2.Cc1cccc2c1-c1cccc3cccc-2c13.Cc1cccc2c1-c1ccccc1C2(c1ccccc1)c1ccccc1.Cc1cccc2c1-c1ccccc1C21c2ccccc2-c2ccccc21.Cc1cccc2ccc3ccccc3c12
InChIInChI=1S/3C26H18.3C26H20.C19H20.4C17H12.C15H12/c1-17-9-8-16-24-25(17)20-12-4-7-15-23(20)26(24)21-13-5-2-10-18(21)19-11-3-6-14-22(19)26;1-17-14-15-25-21(16-17)20-10-4-7-13-24(20)26(25)22-11-5-2-8-18(22)19-9-3-6-12-23(19)26;1-17-14-15-21-20-10-4-7-13-24(20)26(25(21)16-17)22-11-5-2-8-18(22)19-9-3-6-12-23(19)26;1-19-11-10-18-24-25(19)22-16-8-9-17-23(22)26(24,20-12-4-2-5-13-20)21-14-6-3-7-15-21;1-19-16-17-25-23(18-19)22-14-8-9-15-24(22)26(25,20-10-4-2-5-11-20)21-12-6-3-7-13-21;1-19-16-17-23-22-14-8-9-15-24(22)26(25(23)18-19,20-10-4-2-5-11-20)21-12-6-3-7-13-21;1-11-9-14-17-15(10-11)19(4,5)13-8-6-7-12(16(13)17)18(14,2)3;1-11-5-2-8-13-14-9-3-6-12-7-4-10-15(16(11)13)17(12)14;1-11-8-9-13-14-6-2-4-12-5-3-7-15(17(12)14)16(13)10-11;1-11-9-12-5-4-8-15-13-6-2-3-7-14(13)16(10-11)17(12)15;1-11-9-10-16-14-6-3-2-5-13(14)15-8-4-7-12(11)17(15)16;1-11-5-4-7-13-10-9-12-6-2-3-8-14(12)15(11)13/h3*2-16H,1H3;3*2-18H,1H3;6-10H,1-5H3;4*2-10H,1H3;2-10H,1H3
InChIKeyALKCRFWWLFAVQF-UHFFFAOYSA-N
XLogP66.51
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms258
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003294.39
LogP ≤ 566.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;4-methyl-9,9-diphenylfluorene;2-methylfluoranthene;3-methylfluoranthene;7-methylfluoranthene;8-methylfluoranthene;4-methylphenanthrene;2-methyl-9,9'-spirobi[fluorene];3-methyl-9,9'-spirobi[fluorene];4'-methyl-9,9'-spirobi[fluorene];3,6,6,14,14-pentamethyltetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene with MolForge

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Related Compounds

2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;4-methyl-9,9-diphenylfluorene;2,9,9-trimethylfluorene;3,9,9-trimethylfluorene;4,9,9-trimethylfluorene
CID 159829393
2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;bis(4-methyl-9,9-diphenylfluorene)
CID 160627919
2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;bis(4-methyl-9,9-diphenylfluorene);1,9,9-trimethylfluorene
CID 159806985
2-methyl-9,9-diphenylfluorene;1-methylnaphthalene;2-methylnaphthalene;1-methyl-2-phenylbenzene;2-methyl-9,9'-spirobi[fluorene];2,9,9-trimethylfluorene
CID 158540560
3-methylphenanthrene;1-methylpyrene;2-methylpyrene;2-methyltriphenylene;2,9,9-trimethylfluorene;3,9,9-trimethylfluorene
CID 157157152
3-methylfluoranthene;1-methylnaphthalene;1-methyl-4-phenylbenzene;1-methylpyrene;naphthalene;toluene;2,9,9-trimethylfluorene
CID 167628771
9,9-dimethyl-2-(4-methylphenyl)fluorene;2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;1,9,9-trimethylfluorene;2,9,9-trimethylfluorene;3,9,9-trimethylfluorene;4,9,9-trimethylfluorene
CID 162061427
9,9-dimethylfluorene;1-methylnaphthalene;2-methylnaphthalene;9-methyl-9-phenylfluorene;2-methyl-9,9'-spirobi[fluorene];toluene
CID 161053096
bis(9,10-dihydrophenanthrene);9,9-dimethylfluorene;9,9-diphenylfluorene;ethane;3-methylfluoranthene;pyrene;9,9'-spirobi[fluorene];4,5,9,10-tetrahydropyrene
CID 159447619
1-methyl-9,9-diphenylfluorene;2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;4-methyl-9,9-diphenylfluorene;1-methyl-9-phenylcarbazole;2-methyl-9-phenylcarbazole;2,9,9-trimethylfluorene;3,9,9-trimethylfluorene;4,9,9-trimethylfluorene
CID 160789918
2-methyl-9,9'-spirobi[fluorene];bis(4'-methyl-9,9'-spirobi[fluorene])
CID 158761183
3,4'-dimethyl-9,9'-spirobi[fluorene]
CID 145204038

Frequently Asked Questions

What is the IUPAC name of 2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;4-methyl-9,9-diphenylfluorene;2-methylfluoranthene;3-methylfluoranthene;7-methylfluoranthene;8-methylfluoranthene;4-methylphenanthrene;2-methyl-9,9'-spirobi[fluorene];3-methyl-9,9'-spirobi[fluorene];4'-methyl-9,9'-spirobi[fluorene];3,6,6,14,14-pentamethyltetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene?
The IUPAC name of 2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;4-methyl-9,9-diphenylfluorene;2-methylfluoranthene;3-methylfluoranthene;7-methylfluoranthene;8-methylfluoranthene;4-methylphenanthrene;2-methyl-9,9'-spirobi[fluorene];3-methyl-9,9'-spirobi[fluorene];4'-methyl-9,9'-spirobi[fluorene];3,6,6,14,14-pentamethyltetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene (CID 157152340) is 2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;4-methyl-9,9-diphenylfluorene;2-methylfluoranthene;3-methylfluoranthene;7-methylfluoranthene;8-methylfluoranthene;4-methylphenanthrene;2-methyl-9,9'-spirobi[fluorene];3-methyl-9,9'-spirobi[fluorene];4'-methyl-9,9'-spirobi[fluorene];3,6,6,14,14-pentamethyltetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene.
What is the SMILES notation for 2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;4-methyl-9,9-diphenylfluorene;2-methylfluoranthene;3-methylfluoranthene;7-methylfluoranthene;8-methylfluoranthene;4-methylphenanthrene;2-methyl-9,9'-spirobi[fluorene];3-methyl-9,9'-spirobi[fluorene];4'-methyl-9,9'-spirobi[fluorene];3,6,6,14,14-pentamethyltetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene?
The canonical SMILES for 2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;4-methyl-9,9-diphenylfluorene;2-methylfluoranthene;3-methylfluoranthene;7-methylfluoranthene;8-methylfluoranthene;4-methylphenanthrene;2-methyl-9,9'-spirobi[fluorene];3-methyl-9,9'-spirobi[fluorene];4'-methyl-9,9'-spirobi[fluorene];3,6,6,14,14-pentamethyltetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene is Cc1cc2c3c(c1)C(C)(C)c1cccc(c1-3)C2(C)C.Cc1cc2c3c(cccc3c1)-c1ccccc1-2.Cc1ccc2c(c1)-c1cccc3cccc-2c13.Cc1ccc2c(c1)-c1ccccc1C2(c1ccccc1)c1ccccc1.Cc1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2ccccc21.Cc1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1-2.Cc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1ccccc1-2.Cc1ccc2c3c(cccc13)-c1ccccc1-2.Cc1cccc2c1-c1cccc3cccc-2c13.Cc1cccc2c1-c1ccccc1C2(c1ccccc1)c1ccccc1.Cc1cccc2c1-c1ccccc1C21c2ccccc2-c2ccccc21.Cc1cccc2ccc3ccccc3c12.
What is the InChIKey of 2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;4-methyl-9,9-diphenylfluorene;2-methylfluoranthene;3-methylfluoranthene;7-methylfluoranthene;8-methylfluoranthene;4-methylphenanthrene;2-methyl-9,9'-spirobi[fluorene];3-methyl-9,9'-spirobi[fluorene];4'-methyl-9,9'-spirobi[fluorene];3,6,6,14,14-pentamethyltetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene?
The InChIKey is ALKCRFWWLFAVQF-UHFFFAOYSA-N. The full InChI is InChI=1S/3C26H18.3C26H20.C19H20.4C17H12.C15H12/c1-17-9-8-16-24-25(17)20-12-4-7-15-23(20)26(24)21-13-5-2-10-18(21)19-11-3-6-14-22(19)26;1-17-14-15-25-21(16-17)20-10-4-7-13-24(20)26(25)22-11-5-2-8-18(22)19-9-3-6-12-23(19)26;1-17-14-15-21-20-10-4-7-13-24(20)26(25(21)16-17)22-11-5-2-8-18(22)19-9-3-6-12-23(19)26;1-19-11-10-18-24-25(19)22-16-8-9-17-23(22)26(24,20-12-4-2-5-13-20)21-14-6-3-7-15-21;1-19-16-17-25-23(18-19)22-14-8-9-15-24(22)26(25,20-10-4-2-5-11-20)21-12-6-3-7-13-21;1-19-16-17-23-22-14-8-9-15-24(22)26(25(23)18-19,20-10-4-2-5-11-20)21-12-6-3-7-13-21;1-11-9-14-17-15(10-11)19(4,5)13-8-6-7-12(16(13)17)18(14,2)3;1-11-5-2-8-13-14-9-3-6-12-7-4-10-15(16(11)13)17(12)14;1-11-8-9-13-14-6-2-4-12-5-3-7-15(17(12)14)16(13)10-11;1-11-9-12-5-4-8-15-13-6-2-3-7-14(13)16(10-11)17(12)15;1-11-9-10-16-14-6-3-2-5-13(14)15-8-4-7-12(11)17(15)16;1-11-5-4-7-13-10-9-12-6-2-3-8-14(12)15(11)13/h3*2-16H,1H3;3*2-18H,1H3;6-10H,1-5H3;4*2-10H,1H3;2-10H,1H3.
What are the key properties of 2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;4-methyl-9,9-diphenylfluorene;2-methylfluoranthene;3-methylfluoranthene;7-methylfluoranthene;8-methylfluoranthene;4-methylphenanthrene;2-methyl-9,9'-spirobi[fluorene];3-methyl-9,9'-spirobi[fluorene];4'-methyl-9,9'-spirobi[fluorene];3,6,6,14,14-pentamethyltetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene?
2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;4-methyl-9,9-diphenylfluorene;2-methylfluoranthene;3-methylfluoranthene;7-methylfluoranthene;8-methylfluoranthene;4-methylphenanthrene;2-methyl-9,9'-spirobi[fluorene];3-methyl-9,9'-spirobi[fluorene];4'-methyl-9,9'-spirobi[fluorene];3,6,6,14,14-pentamethyltetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene has a molecular weight of 3294.39 g/mol, XLogP of 66.51, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;4-methyl-9,9-diphenylfluorene;2-methylfluoranthene;3-methylfluoranthene;7-methylfluoranthene;8-methylfluoranthene;4-methylphenanthrene;2-methyl-9,9'-spirobi[fluorene];3-methyl-9,9'-spirobi[fluorene];4'-methyl-9,9'-spirobi[fluorene];3,6,6,14,14-pentamethyltetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene is sourced from PubChem (CID 157152340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).