7,7-dimethyl-10-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[c]fluorene;7,7-dimethyl-10-[4-(10-phenylanthracen-9-yl)phenyl]benzo[c]fluorene

C94H66 — CID 157086899

IUPAC7,7-dimethyl-10-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[c]fluorene;7,7-dimethyl-10-[4-(10-phenylanthracen-9-yl)phenyl]benzo[c]fluorene
SMILESCC1(C)c2ccc(-c3ccc(-c4c5ccccc5c(-c5ccc6ccccc6c5)c5ccccc45)cc3)cc2-c2c1ccc1ccccc21.CC1(C)c2ccc(-c3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc3)cc2-c2c1ccc1ccccc21
InChIInChI=1S/C49H34.C45H32/c1-49(2)44-27-26-36(30-43(44)48-38-14-6-5-12-33(38)25-28-45(48)49)32-19-22-34(23-20-32)46-39-15-7-9-17-41(39)47(42-18-10-8-16-40(42)46)37-24-21-31-11-3-4-13-35(31)29-37;1-45(2)40-26-25-33(28-39(40)44-34-15-7-6-12-30(34)24-27-41(44)45)29-20-22-32(23-21-29)43-37-18-10-8-16-35(37)42(31-13-4-3-5-14-31)36-17-9-11-19-38(36)43/h3-30H,1-2H3;3-28H,1-2H3
InChIKeyAEERDUFLKLXKRZ-UHFFFAOYSA-N
MW1195.56 g/mol
LogP26.06
Rot. Bonds6

About 7,7-dimethyl-10-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[c]fluorene;7,7-dimethyl-10-[4-(10-phenylanthracen-9-yl)phenyl]benzo[c]fluorene

7,7-dimethyl-10-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[c]fluorene;7,7-dimethyl-10-[4-(10-phenylanthracen-9-yl)phenyl]benzo[c]fluorene (PubChem CID 157086899) has the molecular formula C94H66 and a molecular weight of 1195.56 g/mol. Its IUPAC name is 7,7-dimethyl-10-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[c]fluorene;7,7-dimethyl-10-[4-(10-phenylanthracen-9-yl)phenyl]benzo[c]fluorene.

Molecular Properties

Compound Name7,7-dimethyl-10-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[c]fluorene;7,7-dimethyl-10-[4-(10-phenylanthracen-9-yl)phenyl]benzo[c]fluorene
PubChem CID157086899
Molecular FormulaC94H66
Molecular Weight1195.56 g/mol
Exact Mass1194.52
IUPAC Name7,7-dimethyl-10-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[c]fluorene;7,7-dimethyl-10-[4-(10-phenylanthracen-9-yl)phenyl]benzo[c]fluorene
SMILESCC1(C)c2ccc(-c3ccc(-c4c5ccccc5c(-c5ccc6ccccc6c5)c5ccccc45)cc3)cc2-c2c1ccc1ccccc21.CC1(C)c2ccc(-c3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc3)cc2-c2c1ccc1ccccc21
InChIInChI=1S/C49H34.C45H32/c1-49(2)44-27-26-36(30-43(44)48-38-14-6-5-12-33(38)25-28-45(48)49)32-19-22-34(23-20-32)46-39-15-7-9-17-41(39)47(42-18-10-8-16-40(42)46)37-24-21-31-11-3-4-13-35(31)29-37;1-45(2)40-26-25-33(28-39(40)44-34-15-7-6-12-30(34)24-27-41(44)45)29-20-22-32(23-21-29)43-37-18-10-8-16-35(37)42(31-13-4-3-5-14-31)36-17-9-11-19-38(36)43/h3-30H,1-2H3;3-28H,1-2H3
InChIKeyAEERDUFLKLXKRZ-UHFFFAOYSA-N
XLogP26.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms94
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001195.56
LogP ≤ 526.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 7,7-dimethyl-10-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[c]fluorene;7,7-dimethyl-10-[4-(10-phenylanthracen-9-yl)phenyl]benzo[c]fluorene with MolForge

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Related Compounds

7,7-dimethyl-10-[4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]benzo[c]fluorene;7,7-dimethyl-10-[4-[10-(3-phenanthren-9-ylphenyl)anthracen-9-yl]phenyl]benzo[c]fluorene
CID 161066800
9,9,14,14-tetramethyl-5-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]pentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
CID 140784213
9-[4-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene
CID 59725436
7,7-dimethyl-10-[3-[10-(3-phenanthren-9-ylphenyl)anthracen-9-yl]phenyl]benzo[c]fluorene
CID 140724765
7,7-dimethyl-10-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]benzo[c]fluorene
CID 140724252
9-(9,10-dinaphthalen-2-ylanthracen-2-yl)-7,7-dimethylbenzo[c]fluorene
CID 58323017
9-(9,9-dimethylfluoren-3-yl)-2-naphthalen-2-yl-10-(4-naphthalen-2-ylphenyl)anthracene
CID 59196621
2-[4-[10-(7,7-dimethylbenzo[c]fluoren-10-yl)anthracen-9-yl]phenyl]dibenzofuran
CID 121420972
11,11-dimethyl-9-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]benzo[a]fluorene;11,11-dimethyl-2-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]benzo[b]fluorene;11,11-dimethyl-3-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]benzo[b]fluorene;7,7-dimethyl-9-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]benzo[c]fluorene;7,7-dimethyl-10-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]benzo[c]fluorene;11,11-dimethyl-8-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]benzo[a]fluorene;11,11-dimethyl-9-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]benzo[a]fluorene
CID 158512021
7,7-dimethyl-2-(10-phenylanthracen-9-yl)benzo[c]fluorene
CID 158971637
4-[10-[3-(7,7-dimethylbenzo[c]fluoren-10-yl)phenyl]anthracen-9-yl]benzo[a]anthracene
CID 140724335
7,7-dimethyl-11-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]benzo[c]fluorene
CID 140724375

Frequently Asked Questions

What is the IUPAC name of 7,7-dimethyl-10-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[c]fluorene;7,7-dimethyl-10-[4-(10-phenylanthracen-9-yl)phenyl]benzo[c]fluorene?
The IUPAC name of 7,7-dimethyl-10-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[c]fluorene;7,7-dimethyl-10-[4-(10-phenylanthracen-9-yl)phenyl]benzo[c]fluorene (CID 157086899) is 7,7-dimethyl-10-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[c]fluorene;7,7-dimethyl-10-[4-(10-phenylanthracen-9-yl)phenyl]benzo[c]fluorene.
What is the SMILES notation for 7,7-dimethyl-10-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[c]fluorene;7,7-dimethyl-10-[4-(10-phenylanthracen-9-yl)phenyl]benzo[c]fluorene?
The canonical SMILES for 7,7-dimethyl-10-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[c]fluorene;7,7-dimethyl-10-[4-(10-phenylanthracen-9-yl)phenyl]benzo[c]fluorene is CC1(C)c2ccc(-c3ccc(-c4c5ccccc5c(-c5ccc6ccccc6c5)c5ccccc45)cc3)cc2-c2c1ccc1ccccc21.CC1(C)c2ccc(-c3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc3)cc2-c2c1ccc1ccccc21.
What is the InChIKey of 7,7-dimethyl-10-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[c]fluorene;7,7-dimethyl-10-[4-(10-phenylanthracen-9-yl)phenyl]benzo[c]fluorene?
The InChIKey is AEERDUFLKLXKRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H34.C45H32/c1-49(2)44-27-26-36(30-43(44)48-38-14-6-5-12-33(38)25-28-45(48)49)32-19-22-34(23-20-32)46-39-15-7-9-17-41(39)47(42-18-10-8-16-40(42)46)37-24-21-31-11-3-4-13-35(31)29-37;1-45(2)40-26-25-33(28-39(40)44-34-15-7-6-12-30(34)24-27-41(44)45)29-20-22-32(23-21-29)43-37-18-10-8-16-35(37)42(31-13-4-3-5-14-31)36-17-9-11-19-38(36)43/h3-30H,1-2H3;3-28H,1-2H3.
What are the key properties of 7,7-dimethyl-10-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[c]fluorene;7,7-dimethyl-10-[4-(10-phenylanthracen-9-yl)phenyl]benzo[c]fluorene?
7,7-dimethyl-10-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[c]fluorene;7,7-dimethyl-10-[4-(10-phenylanthracen-9-yl)phenyl]benzo[c]fluorene has a molecular weight of 1195.56 g/mol, XLogP of 26.06, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7-dimethyl-10-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[c]fluorene;7,7-dimethyl-10-[4-(10-phenylanthracen-9-yl)phenyl]benzo[c]fluorene is sourced from PubChem (CID 157086899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).