1,2-bis(2-methylphenyl)-9H-fluorene

C27H22 — CID 23369064

IUPAC1,2-bis(2-methylphenyl)-9H-fluorene
SMILESCc1ccccc1-c1ccc2c(c1-c1ccccc1C)Cc1ccccc1-2
InChIInChI=1S/C27H22/c1-18-9-3-6-12-21(18)25-16-15-24-23-14-8-5-11-20(23)17-26(24)27(25)22-13-7-4-10-19(22)2/h3-16H,17H2,1-2H3
InChIKeyJUZKGOCKWBQPQX-UHFFFAOYSA-N
MW346.47 g/mol
LogP7.21
Rot. Bonds2

About 1,2-bis(2-methylphenyl)-9H-fluorene

1,2-bis(2-methylphenyl)-9H-fluorene (PubChem CID 23369064) has the molecular formula C27H22 and a molecular weight of 346.47 g/mol. Its IUPAC name is 1,2-bis(2-methylphenyl)-9H-fluorene.

Molecular Properties

Compound Name1,2-bis(2-methylphenyl)-9H-fluorene
PubChem CID23369064
Molecular FormulaC27H22
Molecular Weight346.47 g/mol
Exact Mass346.17
IUPAC Name1,2-bis(2-methylphenyl)-9H-fluorene
SMILESCc1ccccc1-c1ccc2c(c1-c1ccccc1C)Cc1ccccc1-2
InChIInChI=1S/C27H22/c1-18-9-3-6-12-21(18)25-16-15-24-23-14-8-5-11-20(23)17-26(24)27(25)22-13-7-4-10-19(22)2/h3-16H,17H2,1-2H3
InChIKeyJUZKGOCKWBQPQX-UHFFFAOYSA-N
XLogP7.21
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500346.47
LogP ≤ 57.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

Pyrene
CID 31423
3-Methylcholanthrene
CID 1674
BENZ(a)ANTHRACENE
CID 5954
Indeno(1,2,3-cd)pyrene
CID 9131
Benzo(B)Fluoranthene
CID 9153
Fluoranthene
CID 9154
Benzo(K)Fluoranthene
CID 9158
Chrysene
CID 9171
7,12-Dimethylbenz(a)anthracene
CID 6001
1-Methylpyrene
CID 16932
Benzo(J)Fluoranthene
CID 9152
Naphthacene
CID 7080

Frequently Asked Questions

What is the IUPAC name of 1,2-bis(2-methylphenyl)-9H-fluorene?
The IUPAC name of 1,2-bis(2-methylphenyl)-9H-fluorene (CID 23369064) is 1,2-bis(2-methylphenyl)-9H-fluorene.
What is the SMILES notation for 1,2-bis(2-methylphenyl)-9H-fluorene?
The canonical SMILES for 1,2-bis(2-methylphenyl)-9H-fluorene is Cc1ccccc1-c1ccc2c(c1-c1ccccc1C)Cc1ccccc1-2.
What is the InChIKey of 1,2-bis(2-methylphenyl)-9H-fluorene?
The InChIKey is JUZKGOCKWBQPQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H22/c1-18-9-3-6-12-21(18)25-16-15-24-23-14-8-5-11-20(23)17-26(24)27(25)22-13-7-4-10-19(22)2/h3-16H,17H2,1-2H3.
What are the key properties of 1,2-bis(2-methylphenyl)-9H-fluorene?
1,2-bis(2-methylphenyl)-9H-fluorene has a molecular weight of 346.47 g/mol, XLogP of 7.21, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(2-methylphenyl)-9H-fluorene is sourced from PubChem (CID 23369064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).