9,9-dimethyl-2-[4-(4-propan-2-ylnaphthalen-1-yl)phenyl]fluorene;9,9-dioctyl-2-phenyl-7-propan-2-ylfluorene;9,9-dioctyl-2-propan-2-ylfluorene;9-naphthalen-1-yl-9-phenyl-2-propan-2-ylfluorene;9-naphthalen-2-yl-9-phenyl-2-propan-2-ylfluorene

C168H182 — CID 162067931

IUPAC9,9-dimethyl-2-[4-(4-propan-2-ylnaphthalen-1-yl)phenyl]fluorene;9,9-dioctyl-2-phenyl-7-propan-2-ylfluorene;9,9-dioctyl-2-propan-2-ylfluorene;9-naphthalen-1-yl-9-phenyl-2-propan-2-ylfluorene;9-naphthalen-2-yl-9-phenyl-2-propan-2-ylfluorene
SMILESCC(C)c1ccc(-c2ccc(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc2)c2ccccc12.CC(C)c1ccc2c(c1)C(c1ccccc1)(c1ccc3ccccc3c1)c1ccccc1-2.CC(C)c1ccc2c(c1)C(c1ccccc1)(c1cccc3ccccc13)c1ccccc1-2.CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccccc3)ccc2-c2ccc(C(C)C)cc21.CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2ccc(C(C)C)cc21
InChIInChI=1S/C38H52.C34H30.2C32H26.C32H48/c1-5-7-9-11-13-18-26-38(27-19-14-12-10-8-6-2)36-28-32(30(3)4)22-24-34(36)35-25-23-33(29-37(35)38)31-20-16-15-17-21-31;1-22(2)26-19-20-27(29-10-6-5-9-28(26)29)24-15-13-23(14-16-24)25-17-18-31-30-11-7-8-12-32(30)34(3,4)33(31)21-25;1-22(2)24-19-20-28-27-16-8-9-17-30(27)32(31(28)21-24,25-13-4-3-5-14-25)29-18-10-12-23-11-6-7-15-26(23)29;1-22(2)24-17-19-29-28-14-8-9-15-30(28)32(31(29)21-24,26-12-4-3-5-13-26)27-18-16-23-10-6-7-11-25(23)20-27;1-5-7-9-11-13-17-23-32(24-18-14-12-10-8-6-2)30-20-16-15-19-28(30)29-22-21-27(26(3)4)25-31(29)32/h15-17,20-25,28-30H,5-14,18-19,26-27H2,1-4H3;5-22H,1-4H3;2*3-22H,1-2H3;15-16,19-22,25-26H,5-14,17-18,23-24H2,1-4H3
InChIKeyZARSXMQHDBTUBF-UHFFFAOYSA-N
MW2201.30 g/mol
LogP49.08
Rot. Bonds40

About 9,9-dimethyl-2-[4-(4-propan-2-ylnaphthalen-1-yl)phenyl]fluorene;9,9-dioctyl-2-phenyl-7-propan-2-ylfluorene;9,9-dioctyl-2-propan-2-ylfluorene;9-naphthalen-1-yl-9-phenyl-2-propan-2-ylfluorene;9-naphthalen-2-yl-9-phenyl-2-propan-2-ylfluorene

9,9-dimethyl-2-[4-(4-propan-2-ylnaphthalen-1-yl)phenyl]fluorene;9,9-dioctyl-2-phenyl-7-propan-2-ylfluorene;9,9-dioctyl-2-propan-2-ylfluorene;9-naphthalen-1-yl-9-phenyl-2-propan-2-ylfluorene;9-naphthalen-2-yl-9-phenyl-2-propan-2-ylfluorene (PubChem CID 162067931) has the molecular formula C168H182 and a molecular weight of 2201.30 g/mol. Its IUPAC name is 9,9-dimethyl-2-[4-(4-propan-2-ylnaphthalen-1-yl)phenyl]fluorene;9,9-dioctyl-2-phenyl-7-propan-2-ylfluorene;9,9-dioctyl-2-propan-2-ylfluorene;9-naphthalen-1-yl-9-phenyl-2-propan-2-ylfluorene;9-naphthalen-2-yl-9-phenyl-2-propan-2-ylfluorene.

Molecular Properties

Compound Name9,9-dimethyl-2-[4-(4-propan-2-ylnaphthalen-1-yl)phenyl]fluorene;9,9-dioctyl-2-phenyl-7-propan-2-ylfluorene;9,9-dioctyl-2-propan-2-ylfluorene;9-naphthalen-1-yl-9-phenyl-2-propan-2-ylfluorene;9-naphthalen-2-yl-9-phenyl-2-propan-2-ylfluorene
PubChem CID162067931
Molecular FormulaC168H182
Molecular Weight2201.30 g/mol
Exact Mass2199.42
IUPAC Name9,9-dimethyl-2-[4-(4-propan-2-ylnaphthalen-1-yl)phenyl]fluorene;9,9-dioctyl-2-phenyl-7-propan-2-ylfluorene;9,9-dioctyl-2-propan-2-ylfluorene;9-naphthalen-1-yl-9-phenyl-2-propan-2-ylfluorene;9-naphthalen-2-yl-9-phenyl-2-propan-2-ylfluorene
SMILESCC(C)c1ccc(-c2ccc(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc2)c2ccccc12.CC(C)c1ccc2c(c1)C(c1ccccc1)(c1ccc3ccccc3c1)c1ccccc1-2.CC(C)c1ccc2c(c1)C(c1ccccc1)(c1cccc3ccccc13)c1ccccc1-2.CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccccc3)ccc2-c2ccc(C(C)C)cc21.CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2ccc(C(C)C)cc21
InChIInChI=1S/C38H52.C34H30.2C32H26.C32H48/c1-5-7-9-11-13-18-26-38(27-19-14-12-10-8-6-2)36-28-32(30(3)4)22-24-34(36)35-25-23-33(29-37(35)38)31-20-16-15-17-21-31;1-22(2)26-19-20-27(29-10-6-5-9-28(26)29)24-15-13-23(14-16-24)25-17-18-31-30-11-7-8-12-32(30)34(3,4)33(31)21-25;1-22(2)24-19-20-28-27-16-8-9-17-30(27)32(31(28)21-24,25-13-4-3-5-14-25)29-18-10-12-23-11-6-7-15-26(23)29;1-22(2)24-17-19-29-28-14-8-9-15-30(28)32(31(29)21-24,26-12-4-3-5-13-26)27-18-16-23-10-6-7-11-25(23)20-27;1-5-7-9-11-13-17-23-32(24-18-14-12-10-8-6-2)30-20-16-15-19-28(30)29-22-21-27(26(3)4)25-31(29)32/h15-17,20-25,28-30H,5-14,18-19,26-27H2,1-4H3;5-22H,1-4H3;2*3-22H,1-2H3;15-16,19-22,25-26H,5-14,17-18,23-24H2,1-4H3
InChIKeyZARSXMQHDBTUBF-UHFFFAOYSA-N
XLogP49.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds40
Heavy Atoms168
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002201.30
LogP ≤ 549.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 9,9-dimethyl-2-[4-(4-propan-2-ylnaphthalen-1-yl)phenyl]fluorene;9,9-dioctyl-2-phenyl-7-propan-2-ylfluorene;9,9-dioctyl-2-propan-2-ylfluorene;9-naphthalen-1-yl-9-phenyl-2-propan-2-ylfluorene;9-naphthalen-2-yl-9-phenyl-2-propan-2-ylfluorene with MolForge

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Related Compounds

9,9-dimethyl-2-(4-methylphenyl)fluorene;2-methyl-9,9-diphenylfluorene;1-[4-(4-methylphenyl)phenyl]naphthalene;2-[4-(4-methylphenyl)phenyl]naphthalene
CID 157431212
8,30-bis[2-[2-[7-[7-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-4-phenylphenyl]-5,5,33,33-tetramethyl-19,19-dioctylnonacyclo[18.15.0.02,18.04,16.06,15.09,14.022,34.023,32.024,29]pentatriaconta-1(35),2,4(16),6(15),7,9,11,13,17,20,22(34),23(32),24,26,28,30-hexadecaene
CID 156624221
8,30-bis[4-[4-[7-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-2,5-dimethylphenyl]phenyl]-19-heptyl-5,5,33,33-tetramethyl-19-octylnonacyclo[18.15.0.02,18.04,16.06,15.09,14.022,34.023,32.024,29]pentatriaconta-1(35),2,4(16),6(15),7,9,11,13,17,20,22(34),23(32),24,26,28,30-hexadecaene
CID 168838191
9,9-dihexyl-N-(4-phenylphenyl)-N-(4-triphenylsilylphenyl)fluoren-2-amine;9,9-dimethyl-N-(4-phenylphenyl)-N-(4-triphenylsilylphenyl)fluoren-2-amine;9,9-diphenyl-N-(4-phenylphenyl)-N-(4-triphenylsilylphenyl)fluoren-2-amine
CID 157304996
9,9-dioctyl-2-(4-phenylphenyl)fluorene
CID 101073015
2-[9,9-dimethyl-7-(4-methylnaphthalen-1-yl)fluoren-2-yl]-7-[4-[7-[7-[4-[7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dioctylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dioctylfluorene
CID 169036311
8,30-bis[4-[7-(9,9-dimethylfluoren-2-yl)-9,9-dioctylfluoren-2-yl]phenyl]-5,5,33,33-tetramethyl-19,19-dioctylnonacyclo[18.15.0.02,18.04,16.06,15.09,14.022,34.023,32.024,29]pentatriaconta-1(35),2,4(16),6(15),7,9,11,13,17,20,22(34),23(32),24,26,28,30-hexadecaene
CID 156624104
2-[4-[naphthalen-1-yl-(4-naphthalen-1-ylphenyl)methyl]phenyl]-9-phenyl-9-(3-phenylphenyl)fluorene
CID 176786196
2-[(9,9-dimethylfluoren-3-yl)-naphthalen-2-ylmethyl]-6,9,9-triphenylfluorene
CID 165030326
9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-[4-(7-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(7-phenylnaphthalen-1-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-(7-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine;N,9,9-triphenyl-N-[4-(7-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine
CID 160929151
9,9-dimethyl-2-naphthalen-1-yl-7-(3-propan-2-ylphenyl)fluorene
CID 140584073
9,9-bis(4-methylphenyl)fluorene;9-butyl-9-propylfluorene;9,9-diethylfluorene;bis(9,9-dimethylfluorene);9,9-diphenylfluorene;1-methylnaphthalene;2-methylnaphthalene;nonakis(2-methylpropane);toluene;tris(triphenylene)
CID 157491370

Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-2-[4-(4-propan-2-ylnaphthalen-1-yl)phenyl]fluorene;9,9-dioctyl-2-phenyl-7-propan-2-ylfluorene;9,9-dioctyl-2-propan-2-ylfluorene;9-naphthalen-1-yl-9-phenyl-2-propan-2-ylfluorene;9-naphthalen-2-yl-9-phenyl-2-propan-2-ylfluorene?
The IUPAC name of 9,9-dimethyl-2-[4-(4-propan-2-ylnaphthalen-1-yl)phenyl]fluorene;9,9-dioctyl-2-phenyl-7-propan-2-ylfluorene;9,9-dioctyl-2-propan-2-ylfluorene;9-naphthalen-1-yl-9-phenyl-2-propan-2-ylfluorene;9-naphthalen-2-yl-9-phenyl-2-propan-2-ylfluorene (CID 162067931) is 9,9-dimethyl-2-[4-(4-propan-2-ylnaphthalen-1-yl)phenyl]fluorene;9,9-dioctyl-2-phenyl-7-propan-2-ylfluorene;9,9-dioctyl-2-propan-2-ylfluorene;9-naphthalen-1-yl-9-phenyl-2-propan-2-ylfluorene;9-naphthalen-2-yl-9-phenyl-2-propan-2-ylfluorene.
What is the SMILES notation for 9,9-dimethyl-2-[4-(4-propan-2-ylnaphthalen-1-yl)phenyl]fluorene;9,9-dioctyl-2-phenyl-7-propan-2-ylfluorene;9,9-dioctyl-2-propan-2-ylfluorene;9-naphthalen-1-yl-9-phenyl-2-propan-2-ylfluorene;9-naphthalen-2-yl-9-phenyl-2-propan-2-ylfluorene?
The canonical SMILES for 9,9-dimethyl-2-[4-(4-propan-2-ylnaphthalen-1-yl)phenyl]fluorene;9,9-dioctyl-2-phenyl-7-propan-2-ylfluorene;9,9-dioctyl-2-propan-2-ylfluorene;9-naphthalen-1-yl-9-phenyl-2-propan-2-ylfluorene;9-naphthalen-2-yl-9-phenyl-2-propan-2-ylfluorene is CC(C)c1ccc(-c2ccc(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc2)c2ccccc12.CC(C)c1ccc2c(c1)C(c1ccccc1)(c1ccc3ccccc3c1)c1ccccc1-2.CC(C)c1ccc2c(c1)C(c1ccccc1)(c1cccc3ccccc13)c1ccccc1-2.CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccccc3)ccc2-c2ccc(C(C)C)cc21.CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2ccc(C(C)C)cc21.
What is the InChIKey of 9,9-dimethyl-2-[4-(4-propan-2-ylnaphthalen-1-yl)phenyl]fluorene;9,9-dioctyl-2-phenyl-7-propan-2-ylfluorene;9,9-dioctyl-2-propan-2-ylfluorene;9-naphthalen-1-yl-9-phenyl-2-propan-2-ylfluorene;9-naphthalen-2-yl-9-phenyl-2-propan-2-ylfluorene?
The InChIKey is ZARSXMQHDBTUBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H52.C34H30.2C32H26.C32H48/c1-5-7-9-11-13-18-26-38(27-19-14-12-10-8-6-2)36-28-32(30(3)4)22-24-34(36)35-25-23-33(29-37(35)38)31-20-16-15-17-21-31;1-22(2)26-19-20-27(29-10-6-5-9-28(26)29)24-15-13-23(14-16-24)25-17-18-31-30-11-7-8-12-32(30)34(3,4)33(31)21-25;1-22(2)24-19-20-28-27-16-8-9-17-30(27)32(31(28)21-24,25-13-4-3-5-14-25)29-18-10-12-23-11-6-7-15-26(23)29;1-22(2)24-17-19-29-28-14-8-9-15-30(28)32(31(29)21-24,26-12-4-3-5-13-26)27-18-16-23-10-6-7-11-25(23)20-27;1-5-7-9-11-13-17-23-32(24-18-14-12-10-8-6-2)30-20-16-15-19-28(30)29-22-21-27(26(3)4)25-31(29)32/h15-17,20-25,28-30H,5-14,18-19,26-27H2,1-4H3;5-22H,1-4H3;2*3-22H,1-2H3;15-16,19-22,25-26H,5-14,17-18,23-24H2,1-4H3.
What are the key properties of 9,9-dimethyl-2-[4-(4-propan-2-ylnaphthalen-1-yl)phenyl]fluorene;9,9-dioctyl-2-phenyl-7-propan-2-ylfluorene;9,9-dioctyl-2-propan-2-ylfluorene;9-naphthalen-1-yl-9-phenyl-2-propan-2-ylfluorene;9-naphthalen-2-yl-9-phenyl-2-propan-2-ylfluorene?
9,9-dimethyl-2-[4-(4-propan-2-ylnaphthalen-1-yl)phenyl]fluorene;9,9-dioctyl-2-phenyl-7-propan-2-ylfluorene;9,9-dioctyl-2-propan-2-ylfluorene;9-naphthalen-1-yl-9-phenyl-2-propan-2-ylfluorene;9-naphthalen-2-yl-9-phenyl-2-propan-2-ylfluorene has a molecular weight of 2201.30 g/mol, XLogP of 49.08, 40 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-2-[4-(4-propan-2-ylnaphthalen-1-yl)phenyl]fluorene;9,9-dioctyl-2-phenyl-7-propan-2-ylfluorene;9,9-dioctyl-2-propan-2-ylfluorene;9-naphthalen-1-yl-9-phenyl-2-propan-2-ylfluorene;9-naphthalen-2-yl-9-phenyl-2-propan-2-ylfluorene is sourced from PubChem (CID 162067931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).