9-(9,9-dimethylfluoren-2-yl)-10-(9,9-dimethylfluoren-3-yl)-2-methylanthracene;3-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]fluoranthene;2'-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]spiro[1,3-dihydroindene-2,9'-fluorene]

C142H106 — CID 157490912

IUPAC9-(9,9-dimethylfluoren-2-yl)-10-(9,9-dimethylfluoren-3-yl)-2-methylanthracene;3-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]fluoranthene;2'-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]spiro[1,3-dihydroindene-2,9'-fluorene]
SMILESCc1ccc2c(-c3ccc4c(c3)-c3ccccc3C4(C)C)c3ccccc3c(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)c2c1.Cc1ccc2c(-c3ccc4c(c3)C3(Cc5ccccc5C3)c3ccccc3-4)c3ccccc3c(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)c2c1.Cc1ccc2c(-c3ccc4c5c(cccc35)-c3ccccc3-4)c3ccccc3c(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)c2c1
InChIInChI=1S/C51H38.C46H32.C45H36/c1-31-20-23-42-43(26-31)49(32-21-24-38-36-14-8-10-18-44(36)50(2,3)46(38)27-32)41-17-7-6-16-40(41)48(42)33-22-25-39-37-15-9-11-19-45(37)51(47(39)28-33)29-34-12-4-5-13-35(34)30-51;1-27-19-21-39-40(25-27)43(28-20-22-32-31-13-8-9-18-41(31)46(2,3)42(32)26-28)34-14-6-7-15-35(34)45(39)38-24-23-37-30-12-5-4-11-29(30)33-16-10-17-36(38)44(33)37;1-27-18-21-35-37(24-27)43(29-19-22-32-30-12-8-10-16-38(30)45(4,5)41(32)26-29)34-15-7-6-14-33(34)42(35)28-20-23-40-36(25-28)31-13-9-11-17-39(31)44(40,2)3/h4-28H,29-30H2,1-3H3;4-26H,1-3H3;6-26H,1-5H3
InChIKeyBXGLGDOKPNJJLY-UHFFFAOYSA-N
MW1812.41 g/mol
LogP38.00
Rot. Bonds6

About 9-(9,9-dimethylfluoren-2-yl)-10-(9,9-dimethylfluoren-3-yl)-2-methylanthracene;3-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]fluoranthene;2'-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]spiro[1,3-dihydroindene-2,9'-fluorene]

9-(9,9-dimethylfluoren-2-yl)-10-(9,9-dimethylfluoren-3-yl)-2-methylanthracene;3-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]fluoranthene;2'-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]spiro[1,3-dihydroindene-2,9'-fluorene] (PubChem CID 157490912) has the molecular formula C142H106 and a molecular weight of 1812.41 g/mol. Its IUPAC name is 9-(9,9-dimethylfluoren-2-yl)-10-(9,9-dimethylfluoren-3-yl)-2-methylanthracene;3-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]fluoranthene;2'-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]spiro[1,3-dihydroindene-2,9'-fluorene].

Molecular Properties

Compound Name9-(9,9-dimethylfluoren-2-yl)-10-(9,9-dimethylfluoren-3-yl)-2-methylanthracene;3-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]fluoranthene;2'-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]spiro[1,3-dihydroindene-2,9'-fluorene]
PubChem CID157490912
Molecular FormulaC142H106
Molecular Weight1812.41 g/mol
Exact Mass1810.83
IUPAC Name9-(9,9-dimethylfluoren-2-yl)-10-(9,9-dimethylfluoren-3-yl)-2-methylanthracene;3-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]fluoranthene;2'-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]spiro[1,3-dihydroindene-2,9'-fluorene]
SMILESCc1ccc2c(-c3ccc4c(c3)-c3ccccc3C4(C)C)c3ccccc3c(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)c2c1.Cc1ccc2c(-c3ccc4c(c3)C3(Cc5ccccc5C3)c3ccccc3-4)c3ccccc3c(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)c2c1.Cc1ccc2c(-c3ccc4c5c(cccc35)-c3ccccc3-4)c3ccccc3c(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)c2c1
InChIInChI=1S/C51H38.C46H32.C45H36/c1-31-20-23-42-43(26-31)49(32-21-24-38-36-14-8-10-18-44(36)50(2,3)46(38)27-32)41-17-7-6-16-40(41)48(42)33-22-25-39-37-15-9-11-19-45(37)51(47(39)28-33)29-34-12-4-5-13-35(34)30-51;1-27-19-21-39-40(25-27)43(28-20-22-32-31-13-8-9-18-41(31)46(2,3)42(32)26-28)34-14-6-7-15-35(34)45(39)38-24-23-37-30-12-5-4-11-29(30)33-16-10-17-36(38)44(33)37;1-27-18-21-35-37(24-27)43(29-19-22-32-30-12-8-10-16-38(30)45(4,5)41(32)26-29)34-15-7-6-14-33(34)42(35)28-20-23-40-36(25-28)31-13-9-11-17-39(31)44(40,2)3/h4-28H,29-30H2,1-3H3;4-26H,1-3H3;6-26H,1-5H3
InChIKeyBXGLGDOKPNJJLY-UHFFFAOYSA-N
XLogP38.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms142
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001812.41
LogP ≤ 538.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 9-(9,9-dimethylfluoren-2-yl)-10-(9,9-dimethylfluoren-3-yl)-2-methylanthracene;3-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]fluoranthene;2'-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]spiro[1,3-dihydroindene-2,9'-fluorene] with MolForge

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Related Compounds

3-[10-(9,9-dimethylfluoren-2-yl)-2-phenylanthracen-9-yl]fluoranthene
CID 58323064
9-(9,9-dimethylfluoren-2-yl)-10-(9,9-dimethylfluoren-3-yl)-2-naphthalen-1-ylanthracene;3-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-1-ylanthracen-9-yl]fluoranthene
CID 160542211
9-(9,9-dimethylfluoren-2-yl)-10-[10-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-3-methylanthracen-9-yl]-2-methylanthracene
CID 58782810
9-(9,9-dimethylfluoren-2-yl)-10-[2-(9,9-dimethylfluoren-2-yl)phenyl]-2-methylanthracene
CID 59195744
10-(9,9-dimethylfluoren-2-yl)-2,9-diphenylanthracene;3-[10-(9,9-dimethylfluoren-2-yl)-2-phenylanthracen-9-yl]fluoranthene;3-[10-(9,9-dimethylfluoren-2-yl)-3-phenylanthracen-9-yl]fluoranthene;1-(10-fluoranthen-3-yl-2-phenylanthracen-9-yl)pyrene;1-(10-fluoranthen-3-yl-3-phenylanthracen-9-yl)pyrene
CID 158578384
2'-[3-(9,9-dimethylfluoren-2-yl)-10-(9,9-dimethylfluoren-3-yl)anthracen-9-yl]spiro[cyclopentane-1,9'-fluorene]
CID 59195936
2'-[10-(9,9-dimethylfluoren-4-yl)-3-naphthalen-2-ylanthracen-9-yl]spiro[1,3-dihydroindene-2,9'-fluorene]
CID 59196344
9-(9,9-dimethylfluoren-3-yl)-10-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylanthracene
CID 59195039
21-fluoranthen-3-yl-10,10-dimethyl-14-phenylpentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(21),2,4,6,8,11,13,15,17,19-decaene
CID 58175506
4-[10-(9,9-dimethylfluoren-3-yl)-3-methylanthracen-9-yl]pyrimidine
CID 59195491
3-[10-(9,9-dimethylfluoren-3-yl)-3-phenylanthracen-9-yl]perylene;2-[10-(9,9-dimethylfluoren-3-yl)-3-phenylanthracen-9-yl]-9,9'-spirobi[fluorene];2'-[10-(9,9-dimethylfluoren-3-yl)-3-phenylanthracen-9-yl]spiro[cyclopentane-1,9'-fluorene]
CID 161380807
3-[10-(9,9-dimethylfluoren-3-yl)-3-methylanthracen-9-yl]-10-methyl-9H-acridine
CID 59195073

Frequently Asked Questions

What is the IUPAC name of 9-(9,9-dimethylfluoren-2-yl)-10-(9,9-dimethylfluoren-3-yl)-2-methylanthracene;3-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]fluoranthene;2'-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]spiro[1,3-dihydroindene-2,9'-fluorene]?
The IUPAC name of 9-(9,9-dimethylfluoren-2-yl)-10-(9,9-dimethylfluoren-3-yl)-2-methylanthracene;3-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]fluoranthene;2'-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]spiro[1,3-dihydroindene-2,9'-fluorene] (CID 157490912) is 9-(9,9-dimethylfluoren-2-yl)-10-(9,9-dimethylfluoren-3-yl)-2-methylanthracene;3-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]fluoranthene;2'-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]spiro[1,3-dihydroindene-2,9'-fluorene].
What is the SMILES notation for 9-(9,9-dimethylfluoren-2-yl)-10-(9,9-dimethylfluoren-3-yl)-2-methylanthracene;3-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]fluoranthene;2'-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]spiro[1,3-dihydroindene-2,9'-fluorene]?
The canonical SMILES for 9-(9,9-dimethylfluoren-2-yl)-10-(9,9-dimethylfluoren-3-yl)-2-methylanthracene;3-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]fluoranthene;2'-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]spiro[1,3-dihydroindene-2,9'-fluorene] is Cc1ccc2c(-c3ccc4c(c3)-c3ccccc3C4(C)C)c3ccccc3c(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)c2c1.Cc1ccc2c(-c3ccc4c(c3)C3(Cc5ccccc5C3)c3ccccc3-4)c3ccccc3c(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)c2c1.Cc1ccc2c(-c3ccc4c5c(cccc35)-c3ccccc3-4)c3ccccc3c(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)c2c1.
What is the InChIKey of 9-(9,9-dimethylfluoren-2-yl)-10-(9,9-dimethylfluoren-3-yl)-2-methylanthracene;3-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]fluoranthene;2'-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]spiro[1,3-dihydroindene-2,9'-fluorene]?
The InChIKey is BXGLGDOKPNJJLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H38.C46H32.C45H36/c1-31-20-23-42-43(26-31)49(32-21-24-38-36-14-8-10-18-44(36)50(2,3)46(38)27-32)41-17-7-6-16-40(41)48(42)33-22-25-39-37-15-9-11-19-45(37)51(47(39)28-33)29-34-12-4-5-13-35(34)30-51;1-27-19-21-39-40(25-27)43(28-20-22-32-31-13-8-9-18-41(31)46(2,3)42(32)26-28)34-14-6-7-15-35(34)45(39)38-24-23-37-30-12-5-4-11-29(30)33-16-10-17-36(38)44(33)37;1-27-18-21-35-37(24-27)43(29-19-22-32-30-12-8-10-16-38(30)45(4,5)41(32)26-29)34-15-7-6-14-33(34)42(35)28-20-23-40-36(25-28)31-13-9-11-17-39(31)44(40,2)3/h4-28H,29-30H2,1-3H3;4-26H,1-3H3;6-26H,1-5H3.
What are the key properties of 9-(9,9-dimethylfluoren-2-yl)-10-(9,9-dimethylfluoren-3-yl)-2-methylanthracene;3-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]fluoranthene;2'-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]spiro[1,3-dihydroindene-2,9'-fluorene]?
9-(9,9-dimethylfluoren-2-yl)-10-(9,9-dimethylfluoren-3-yl)-2-methylanthracene;3-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]fluoranthene;2'-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]spiro[1,3-dihydroindene-2,9'-fluorene] has a molecular weight of 1812.41 g/mol, XLogP of 38.00, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(9,9-dimethylfluoren-2-yl)-10-(9,9-dimethylfluoren-3-yl)-2-methylanthracene;3-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]fluoranthene;2'-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]spiro[1,3-dihydroindene-2,9'-fluorene] is sourced from PubChem (CID 157490912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).