9,9-dimethyl-1-[(4-phenylphenyl)methyl]fluorene

C28H24 — CID 144558289

IUPAC9,9-dimethyl-1-[(4-phenylphenyl)methyl]fluorene
SMILESCC1(C)c2ccccc2-c2cccc(Cc3ccc(-c4ccccc4)cc3)c21
InChIInChI=1S/C28H24/c1-28(2)26-14-7-6-12-24(26)25-13-8-11-23(27(25)28)19-20-15-17-22(18-16-20)21-9-4-3-5-10-21/h3-18H,19H2,1-2H3
InChIKeyVLCKIZJMGRLPRL-UHFFFAOYSA-N
MW360.50 g/mol
LogP7.25
Rot. Bonds3

About 9,9-dimethyl-1-[(4-phenylphenyl)methyl]fluorene

9,9-dimethyl-1-[(4-phenylphenyl)methyl]fluorene (PubChem CID 144558289) has the molecular formula C28H24 and a molecular weight of 360.50 g/mol. Its IUPAC name is 9,9-dimethyl-1-[(4-phenylphenyl)methyl]fluorene.

Molecular Properties

Compound Name9,9-dimethyl-1-[(4-phenylphenyl)methyl]fluorene
PubChem CID144558289
Molecular FormulaC28H24
Molecular Weight360.50 g/mol
Exact Mass360.19
IUPAC Name9,9-dimethyl-1-[(4-phenylphenyl)methyl]fluorene
SMILESCC1(C)c2ccccc2-c2cccc(Cc3ccc(-c4ccccc4)cc3)c21
InChIInChI=1S/C28H24/c1-28(2)26-14-7-6-12-24(26)25-13-8-11-23(27(25)28)19-20-15-17-22(18-16-20)21-9-4-3-5-10-21/h3-18H,19H2,1-2H3
InChIKeyVLCKIZJMGRLPRL-UHFFFAOYSA-N
XLogP7.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.50
LogP ≤ 57.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

9,9-dimethyl-1-phenylfluorene;methane
CID 142541097
2-[(9,9-dimethylfluoren-2-yl)methyl]-9,9-dimethyl-7-phenylfluorene
CID 157190437
N-[4-[4-benzyl-3-(2-benzylphenyl)phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-4-amine
CID 155214818
2-[3-(9,9-dimethylfluoren-1-yl)phenyl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 129150867
N-[4-(11,11-dimethylbenzo[a]fluoren-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 139363610
9,9-dimethyl-N-phenyl-2-[4-(N-phenylanilino)phenyl]-N-(4-phenylphenyl)fluoren-1-amine
CID 167255464
1-(4-chlorophenyl)-9,9-dimethylfluorene
CID 118193752
3-[3-benzyl-5-(9,9-dimethylfluoren-3-yl)phenyl]-9,9-dimethylfluorene
CID 145377641
5,5,19,19-tetramethyl-2,16-diphenylheptacyclo[15.11.0.03,15.04,12.06,11.018,26.020,25]octacosa-1,3(15),4(12),6,8,10,13,16,18(26),20,22,24,27-tridecaene
CID 58142415
4-[4-[3-(9,9-dimethylfluoren-1-yl)phenyl]phenyl]-2,6-diphenylpyrimidine
CID 167344597
4-[3-[4-(9,9-dimethylfluoren-1-yl)phenyl]phenyl]-2,6-bis(3-phenylphenyl)pyrimidine
CID 167344536
2-[3-[4-(9,9-dimethylfluoren-1-yl)phenyl]phenyl]-4,6-diphenylpyrimidine
CID 167344623

Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-1-[(4-phenylphenyl)methyl]fluorene?
The IUPAC name of 9,9-dimethyl-1-[(4-phenylphenyl)methyl]fluorene (CID 144558289) is 9,9-dimethyl-1-[(4-phenylphenyl)methyl]fluorene.
What is the SMILES notation for 9,9-dimethyl-1-[(4-phenylphenyl)methyl]fluorene?
The canonical SMILES for 9,9-dimethyl-1-[(4-phenylphenyl)methyl]fluorene is CC1(C)c2ccccc2-c2cccc(Cc3ccc(-c4ccccc4)cc3)c21.
What is the InChIKey of 9,9-dimethyl-1-[(4-phenylphenyl)methyl]fluorene?
The InChIKey is VLCKIZJMGRLPRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H24/c1-28(2)26-14-7-6-12-24(26)25-13-8-11-23(27(25)28)19-20-15-17-22(18-16-20)21-9-4-3-5-10-21/h3-18H,19H2,1-2H3.
What are the key properties of 9,9-dimethyl-1-[(4-phenylphenyl)methyl]fluorene?
9,9-dimethyl-1-[(4-phenylphenyl)methyl]fluorene has a molecular weight of 360.50 g/mol, XLogP of 7.25, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-1-[(4-phenylphenyl)methyl]fluorene is sourced from PubChem (CID 144558289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).