9,9-bis(3-tert-butylphenyl)-2-methylfluorene;2',7'-ditert-butyl-2-methyl-9,9'-spirobi[fluorene];2-methylspiro[fluorene-9,9'-xanthene];2'-methylspiro[fluorene-9,9'-xanthene];4'-methylspiro[fluorene-9,9'-xanthene]

C146H124O3 — CID 163917294

IUPAC9,9-bis(3-tert-butylphenyl)-2-methylfluorene;2',7'-ditert-butyl-2-methyl-9,9'-spirobi[fluorene];2-methylspiro[fluorene-9,9'-xanthene];2'-methylspiro[fluorene-9,9'-xanthene];4'-methylspiro[fluorene-9,9'-xanthene]
SMILESCc1ccc2c(c1)C(c1cccc(C(C)(C)C)c1)(c1cccc(C(C)(C)C)c1)c1ccccc1-2.Cc1ccc2c(c1)C1(c3ccccc3-2)c2cc(C(C)(C)C)ccc2-c2ccc(C(C)(C)C)cc21.Cc1ccc2c(c1)C1(c3ccccc3O2)c2ccccc2-c2ccccc21.Cc1ccc2c(c1)C1(c3ccccc3Oc3ccccc31)c1ccccc1-2.Cc1cccc2c1Oc1ccccc1C21c2ccccc2-c2ccccc21
InChIInChI=1S/C34H34.C34H36.3C26H18O/c1-21-12-15-25-24-10-8-9-11-28(24)34(29(25)18-21)30-19-22(32(2,3)4)13-16-26(30)27-17-14-23(20-31(27)34)33(5,6)7;1-23-18-19-29-28-16-8-9-17-30(28)34(31(29)20-23,26-14-10-12-24(21-26)32(2,3)4)27-15-11-13-25(22-27)33(5,6)7;1-17-9-8-15-23-25(17)27-24-16-7-6-14-22(24)26(23)20-12-4-2-10-18(20)19-11-3-5-13-21(19)26;1-17-14-15-25-23(16-17)26(22-12-6-7-13-24(22)27-25)20-10-4-2-8-18(20)19-9-3-5-11-21(19)26;1-17-14-15-19-18-8-2-3-9-20(18)26(23(19)16-17)21-10-4-6-12-24(21)27-25-13-7-5-11-22(25)26/h8-20H,1-7H3;8-22H,1-7H3;3*2-16H,1H3
InChIKeyQXJDWMXEJXEKCQ-UHFFFAOYSA-N
MW1926.59 g/mol
LogP37.28
Rot. Bonds2

About 9,9-bis(3-tert-butylphenyl)-2-methylfluorene;2',7'-ditert-butyl-2-methyl-9,9'-spirobi[fluorene];2-methylspiro[fluorene-9,9'-xanthene];2'-methylspiro[fluorene-9,9'-xanthene];4'-methylspiro[fluorene-9,9'-xanthene]

9,9-bis(3-tert-butylphenyl)-2-methylfluorene;2',7'-ditert-butyl-2-methyl-9,9'-spirobi[fluorene];2-methylspiro[fluorene-9,9'-xanthene];2'-methylspiro[fluorene-9,9'-xanthene];4'-methylspiro[fluorene-9,9'-xanthene] (PubChem CID 163917294) has the molecular formula C146H124O3 and a molecular weight of 1926.59 g/mol. Its IUPAC name is 9,9-bis(3-tert-butylphenyl)-2-methylfluorene;2',7'-ditert-butyl-2-methyl-9,9'-spirobi[fluorene];2-methylspiro[fluorene-9,9'-xanthene];2'-methylspiro[fluorene-9,9'-xanthene];4'-methylspiro[fluorene-9,9'-xanthene].

Molecular Properties

Compound Name9,9-bis(3-tert-butylphenyl)-2-methylfluorene;2',7'-ditert-butyl-2-methyl-9,9'-spirobi[fluorene];2-methylspiro[fluorene-9,9'-xanthene];2'-methylspiro[fluorene-9,9'-xanthene];4'-methylspiro[fluorene-9,9'-xanthene]
PubChem CID163917294
Molecular FormulaC146H124O3
Molecular Weight1926.59 g/mol
Exact Mass1924.96
IUPAC Name9,9-bis(3-tert-butylphenyl)-2-methylfluorene;2',7'-ditert-butyl-2-methyl-9,9'-spirobi[fluorene];2-methylspiro[fluorene-9,9'-xanthene];2'-methylspiro[fluorene-9,9'-xanthene];4'-methylspiro[fluorene-9,9'-xanthene]
SMILESCc1ccc2c(c1)C(c1cccc(C(C)(C)C)c1)(c1cccc(C(C)(C)C)c1)c1ccccc1-2.Cc1ccc2c(c1)C1(c3ccccc3-2)c2cc(C(C)(C)C)ccc2-c2ccc(C(C)(C)C)cc21.Cc1ccc2c(c1)C1(c3ccccc3O2)c2ccccc2-c2ccccc21.Cc1ccc2c(c1)C1(c3ccccc3Oc3ccccc31)c1ccccc1-2.Cc1cccc2c1Oc1ccccc1C21c2ccccc2-c2ccccc21
InChIInChI=1S/C34H34.C34H36.3C26H18O/c1-21-12-15-25-24-10-8-9-11-28(24)34(29(25)18-21)30-19-22(32(2,3)4)13-16-26(30)27-17-14-23(20-31(27)34)33(5,6)7;1-23-18-19-29-28-16-8-9-17-30(28)34(31(29)20-23,26-14-10-12-24(21-26)32(2,3)4)27-15-11-13-25(22-27)33(5,6)7;1-17-9-8-15-23-25(17)27-24-16-7-6-14-22(24)26(23)20-12-4-2-10-18(20)19-11-3-5-13-21(19)26;1-17-14-15-25-23(16-17)26(22-12-6-7-13-24(22)27-25)20-10-4-2-8-18(20)19-9-3-5-11-21(19)26;1-17-14-15-19-18-8-2-3-9-20(18)26(23(19)16-17)21-10-4-6-12-24(21)27-25-13-7-5-11-22(25)26/h8-20H,1-7H3;8-22H,1-7H3;3*2-16H,1H3
InChIKeyQXJDWMXEJXEKCQ-UHFFFAOYSA-N
XLogP37.28
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms149
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001926.59
LogP ≤ 537.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 9,9-bis(3-tert-butylphenyl)-2-methylfluorene;2',7'-ditert-butyl-2-methyl-9,9'-spirobi[fluorene];2-methylspiro[fluorene-9,9'-xanthene];2'-methylspiro[fluorene-9,9'-xanthene];4'-methylspiro[fluorene-9,9'-xanthene] with MolForge

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Related Compounds

2'-[9,9-bis(3-tert-butylphenyl)fluoren-4-yl]spiro[fluorene-9,9'-xanthene]
CID 170037301
2,7-ditert-butylspiro[fluorene-9,9'-xanthene]
CID 90153663
2',7'-ditert-butyl-N,N-bis(9,9-diphenylfluoren-2-yl)spiro[fluorene-9,9'-xanthene]-2-amine
CID 174284062
2,7-dimethylspiro[fluorene-9,9'-xanthene]
CID 58250911
2-methyl-7-(trifluoromethyl)spiro[fluorene-9,9'-xanthene]
CID 118965145
1',9,9,9',9'-pentamethyl-10,10'-spirobi[anthracene];2,9,9,9',9'-pentamethyl-10,10'-spirobi[anthracene];2,9',9',10,10-pentamethyl-9,10'-spirobi[anthracene];2',9,9-trimethylspiro[anthracene-10,9'-xanthene];2,10,10-trimethylspiro[anthracene-9,9'-xanthene];4',9,9-trimethylspiro[anthracene-10,9'-xanthene]
CID 163489937
N-[(2,7-ditert-butylspiro[fluorene-9,9'-xanthene]-2'-yl)methyl]-N-(9,9-diphenylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine
CID 174284982
N-(2',7'-ditert-butylspiro[fluorene-9,9'-thioxanthene]-2-yl)-N-(9,9-diphenylfluoren-2-yl)spiro[fluorene-9,9'-xanthene]-2'-amine
CID 174285700
9',17'-dimethylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8,10,12,16,18-nonaene]
CID 160896143
2,7-ditert-butyl-N-naphthalen-1-yl-N-(9,9'-spirobi[fluorene]-2-yl)spiro[fluorene-9,9'-xanthene]-2'-amine
CID 174282092
2,7-ditert-butyl-N-(9,9-diphenylxanthen-2-yl)-N-[2-(4-phenylphenyl)phenyl]spiro[fluorene-9,9'-xanthene]-2'-amine
CID 174282393
2-[2-(2',7'-ditert-butyl-9,9'-spirobi[fluorene]-2-yl)phenyl]-9,9-dimethylxanthene
CID 177127900

Frequently Asked Questions

What is the IUPAC name of 9,9-bis(3-tert-butylphenyl)-2-methylfluorene;2',7'-ditert-butyl-2-methyl-9,9'-spirobi[fluorene];2-methylspiro[fluorene-9,9'-xanthene];2'-methylspiro[fluorene-9,9'-xanthene];4'-methylspiro[fluorene-9,9'-xanthene]?
The IUPAC name of 9,9-bis(3-tert-butylphenyl)-2-methylfluorene;2',7'-ditert-butyl-2-methyl-9,9'-spirobi[fluorene];2-methylspiro[fluorene-9,9'-xanthene];2'-methylspiro[fluorene-9,9'-xanthene];4'-methylspiro[fluorene-9,9'-xanthene] (CID 163917294) is 9,9-bis(3-tert-butylphenyl)-2-methylfluorene;2',7'-ditert-butyl-2-methyl-9,9'-spirobi[fluorene];2-methylspiro[fluorene-9,9'-xanthene];2'-methylspiro[fluorene-9,9'-xanthene];4'-methylspiro[fluorene-9,9'-xanthene].
What is the SMILES notation for 9,9-bis(3-tert-butylphenyl)-2-methylfluorene;2',7'-ditert-butyl-2-methyl-9,9'-spirobi[fluorene];2-methylspiro[fluorene-9,9'-xanthene];2'-methylspiro[fluorene-9,9'-xanthene];4'-methylspiro[fluorene-9,9'-xanthene]?
The canonical SMILES for 9,9-bis(3-tert-butylphenyl)-2-methylfluorene;2',7'-ditert-butyl-2-methyl-9,9'-spirobi[fluorene];2-methylspiro[fluorene-9,9'-xanthene];2'-methylspiro[fluorene-9,9'-xanthene];4'-methylspiro[fluorene-9,9'-xanthene] is Cc1ccc2c(c1)C(c1cccc(C(C)(C)C)c1)(c1cccc(C(C)(C)C)c1)c1ccccc1-2.Cc1ccc2c(c1)C1(c3ccccc3-2)c2cc(C(C)(C)C)ccc2-c2ccc(C(C)(C)C)cc21.Cc1ccc2c(c1)C1(c3ccccc3O2)c2ccccc2-c2ccccc21.Cc1ccc2c(c1)C1(c3ccccc3Oc3ccccc31)c1ccccc1-2.Cc1cccc2c1Oc1ccccc1C21c2ccccc2-c2ccccc21.
What is the InChIKey of 9,9-bis(3-tert-butylphenyl)-2-methylfluorene;2',7'-ditert-butyl-2-methyl-9,9'-spirobi[fluorene];2-methylspiro[fluorene-9,9'-xanthene];2'-methylspiro[fluorene-9,9'-xanthene];4'-methylspiro[fluorene-9,9'-xanthene]?
The InChIKey is QXJDWMXEJXEKCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H34.C34H36.3C26H18O/c1-21-12-15-25-24-10-8-9-11-28(24)34(29(25)18-21)30-19-22(32(2,3)4)13-16-26(30)27-17-14-23(20-31(27)34)33(5,6)7;1-23-18-19-29-28-16-8-9-17-30(28)34(31(29)20-23,26-14-10-12-24(21-26)32(2,3)4)27-15-11-13-25(22-27)33(5,6)7;1-17-9-8-15-23-25(17)27-24-16-7-6-14-22(24)26(23)20-12-4-2-10-18(20)19-11-3-5-13-21(19)26;1-17-14-15-25-23(16-17)26(22-12-6-7-13-24(22)27-25)20-10-4-2-8-18(20)19-9-3-5-11-21(19)26;1-17-14-15-19-18-8-2-3-9-20(18)26(23(19)16-17)21-10-4-6-12-24(21)27-25-13-7-5-11-22(25)26/h8-20H,1-7H3;8-22H,1-7H3;3*2-16H,1H3.
What are the key properties of 9,9-bis(3-tert-butylphenyl)-2-methylfluorene;2',7'-ditert-butyl-2-methyl-9,9'-spirobi[fluorene];2-methylspiro[fluorene-9,9'-xanthene];2'-methylspiro[fluorene-9,9'-xanthene];4'-methylspiro[fluorene-9,9'-xanthene]?
9,9-bis(3-tert-butylphenyl)-2-methylfluorene;2',7'-ditert-butyl-2-methyl-9,9'-spirobi[fluorene];2-methylspiro[fluorene-9,9'-xanthene];2'-methylspiro[fluorene-9,9'-xanthene];4'-methylspiro[fluorene-9,9'-xanthene] has a molecular weight of 1926.59 g/mol, XLogP of 37.28, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-bis(3-tert-butylphenyl)-2-methylfluorene;2',7'-ditert-butyl-2-methyl-9,9'-spirobi[fluorene];2-methylspiro[fluorene-9,9'-xanthene];2'-methylspiro[fluorene-9,9'-xanthene];4'-methylspiro[fluorene-9,9'-xanthene] is sourced from PubChem (CID 163917294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).