2,3-bis(3-methylphenyl)fluoren-9-one

C27H20O — CID 102493573

IUPAC2,3-bis(3-methylphenyl)fluoren-9-one
SMILESCc1cccc(-c2cc3c(cc2-c2cccc(C)c2)-c2ccccc2C3=O)c1
InChIInChI=1S/C27H20O/c1-17-7-5-9-19(13-17)23-15-25-21-11-3-4-12-22(21)27(28)26(25)16-24(23)20-10-6-8-18(2)14-20/h3-16H,1-2H3
InChIKeyFJIHQJBFRKRCDR-UHFFFAOYSA-N
MW360.46 g/mol
LogP6.85
Rot. Bonds2

About 2,3-bis(3-methylphenyl)fluoren-9-one

2,3-bis(3-methylphenyl)fluoren-9-one (PubChem CID 102493573) has the molecular formula C27H20O and a molecular weight of 360.46 g/mol. Its IUPAC name is 2,3-bis(3-methylphenyl)fluoren-9-one.

Molecular Properties

Compound Name2,3-bis(3-methylphenyl)fluoren-9-one
PubChem CID102493573
Molecular FormulaC27H20O
Molecular Weight360.46 g/mol
Exact Mass360.15
IUPAC Name2,3-bis(3-methylphenyl)fluoren-9-one
SMILESCc1cccc(-c2cc3c(cc2-c2cccc(C)c2)-c2ccccc2C3=O)c1
InChIInChI=1S/C27H20O/c1-17-7-5-9-19(13-17)23-15-25-21-11-3-4-12-22(21)27(28)26(25)16-24(23)20-10-6-8-18(2)14-20/h3-16H,1-2H3
InChIKeyFJIHQJBFRKRCDR-UHFFFAOYSA-N
XLogP6.85
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.46
LogP ≤ 56.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2,3-diphenylfluoren-9-one
CID 102493574
4-methyl-2-(3-methylphenyl)-1-[2-(3-methylphenyl)phenyl]benzene
CID 58892355
1,2-bis[3-(3-methylphenyl)phenyl]-4,5-diphenylbenzene
CID 59552772
1,4,5,8-tetrakis(3-methylphenyl)anthracene-9,10-dione
CID 25054148
2-(3-methylphenyl)phenol
CID 11206198
2-(3-methylphenyl)-1H-benzo[f]benzimidazole-4,9-dione
CID 122368189
1-(difluoromethyl)-2-(3-methylphenyl)benzene
CID 123429256
3-(3-methylphenyl)fluoranthene
CID 123478210
2-bromo-1,3-bis(3-methylphenyl)benzene
CID 3691341
2-iodo-1,3-bis(3-methylphenyl)benzene
CID 170072024
1,4-bis[3-(4-methylphenyl)phenyl]-2,5-diphenylbenzene;1,3-bis[3-(3-methylphenyl)-5-phenylphenyl]-5-phenylbenzene;1-methyl-2-[3-[2-[2-[3-(2-methylphenyl)phenyl]phenyl]phenyl]phenyl]benzene;1-methyl-4-[3-[2-[2-[3-(4-methylphenyl)phenyl]phenyl]phenyl]phenyl]benzene;1-methyl-4-[3-[3-[3-[3-(4-methylphenyl)phenyl]phenyl]phenyl]phenyl]benzene;1-(3-methylphenyl)-3-[2-[2-[3-(3-methylphenyl)phenyl]phenyl]phenyl]benzene
CID 159620080
2-(3-methylphenyl)-6-phenylaniline
CID 150906011

Frequently Asked Questions

What is the IUPAC name of 2,3-bis(3-methylphenyl)fluoren-9-one?
The IUPAC name of 2,3-bis(3-methylphenyl)fluoren-9-one (CID 102493573) is 2,3-bis(3-methylphenyl)fluoren-9-one.
What is the SMILES notation for 2,3-bis(3-methylphenyl)fluoren-9-one?
The canonical SMILES for 2,3-bis(3-methylphenyl)fluoren-9-one is Cc1cccc(-c2cc3c(cc2-c2cccc(C)c2)-c2ccccc2C3=O)c1.
What is the InChIKey of 2,3-bis(3-methylphenyl)fluoren-9-one?
The InChIKey is FJIHQJBFRKRCDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H20O/c1-17-7-5-9-19(13-17)23-15-25-21-11-3-4-12-22(21)27(28)26(25)16-24(23)20-10-6-8-18(2)14-20/h3-16H,1-2H3.
What are the key properties of 2,3-bis(3-methylphenyl)fluoren-9-one?
2,3-bis(3-methylphenyl)fluoren-9-one has a molecular weight of 360.46 g/mol, XLogP of 6.85, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis(3-methylphenyl)fluoren-9-one is sourced from PubChem (CID 102493573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).