1-(4-methylphenyl)-9,9-diphenylfluorene

C32H24 — CID 123914511

IUPAC1-(4-methylphenyl)-9,9-diphenylfluorene
SMILESCc1ccc(-c2cccc3c2C(c2ccccc2)(c2ccccc2)c2ccccc2-3)cc1
InChIInChI=1S/C32H24/c1-23-19-21-24(22-20-23)27-16-10-17-29-28-15-8-9-18-30(28)32(31(27)29,25-11-4-2-5-12-25)26-13-6-3-7-14-26/h2-22H,1H3
InChIKeyDFDZMWXOODQTRO-UHFFFAOYSA-N
MW408.54 g/mol
LogP8.03
Rot. Bonds3

About 1-(4-methylphenyl)-9,9-diphenylfluorene

1-(4-methylphenyl)-9,9-diphenylfluorene (PubChem CID 123914511) has the molecular formula C32H24 and a molecular weight of 408.54 g/mol. Its IUPAC name is 1-(4-methylphenyl)-9,9-diphenylfluorene.

Molecular Properties

Compound Name1-(4-methylphenyl)-9,9-diphenylfluorene
PubChem CID123914511
Molecular FormulaC32H24
Molecular Weight408.54 g/mol
Exact Mass408.19
IUPAC Name1-(4-methylphenyl)-9,9-diphenylfluorene
SMILESCc1ccc(-c2cccc3c2C(c2ccccc2)(c2ccccc2)c2ccccc2-3)cc1
InChIInChI=1S/C32H24/c1-23-19-21-24(22-20-23)27-16-10-17-29-28-15-8-9-18-30(28)32(31(27)29,25-11-4-2-5-12-25)26-13-6-3-7-14-26/h2-22H,1H3
InChIKeyDFDZMWXOODQTRO-UHFFFAOYSA-N
XLogP8.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500408.54
LogP ≤ 58.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-(3,5-dimethylphenyl)-9,9-diphenylfluorene
CID 159307684
1-(4-bromophenyl)-9,9-diphenylfluorene
CID 172845574
1-(3-methylnaphthalen-1-yl)-9,9-diphenylfluorene
CID 170522173
9,9-bis(4-methylphenyl)fluorene;propane
CID 144938703
tetrakis(9,9-dimethylfluorene);tetrakis(9,9-diphenylfluorene);ethane;toluene
CID 157389689
methane;2-methyl-9,9-diphenylfluorene
CID 144583572
1-methyl-6-[3-(2-methyl-9-phenylfluoren-9-yl)phenyl]-9,9-diphenylfluorene
CID 144938931
2-(9,9-diphenylfluoren-1-yl)-4-phenyl-6-(2-phenylphenyl)-1,3,5-triazine
CID 122416348
6,6,12,12-tetrakis(4-methylphenyl)indeno[1,2-b]fluorene
CID 101421308
1-fluoro-9,9-diphenylfluorene
CID 170080544
9,9-diphenylfluorene;methane
CID 145140147
9,9-diphenylfluorene;methane
CID 145331804

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylphenyl)-9,9-diphenylfluorene?
The IUPAC name of 1-(4-methylphenyl)-9,9-diphenylfluorene (CID 123914511) is 1-(4-methylphenyl)-9,9-diphenylfluorene.
What is the SMILES notation for 1-(4-methylphenyl)-9,9-diphenylfluorene?
The canonical SMILES for 1-(4-methylphenyl)-9,9-diphenylfluorene is Cc1ccc(-c2cccc3c2C(c2ccccc2)(c2ccccc2)c2ccccc2-3)cc1.
What is the InChIKey of 1-(4-methylphenyl)-9,9-diphenylfluorene?
The InChIKey is DFDZMWXOODQTRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H24/c1-23-19-21-24(22-20-23)27-16-10-17-29-28-15-8-9-18-30(28)32(31(27)29,25-11-4-2-5-12-25)26-13-6-3-7-14-26/h2-22H,1H3.
What are the key properties of 1-(4-methylphenyl)-9,9-diphenylfluorene?
1-(4-methylphenyl)-9,9-diphenylfluorene has a molecular weight of 408.54 g/mol, XLogP of 8.03, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylphenyl)-9,9-diphenylfluorene is sourced from PubChem (CID 123914511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).