7-(4-tert-butylphenyl)-9,9-dimethyl-3-(2-methylphenyl)-1,2-dihydrofluorene

C32H34 — CID 156827419

IUPAC7-(4-tert-butylphenyl)-9,9-dimethyl-3-(2-methylphenyl)-1,2-dihydrofluorene
SMILESCc1ccccc1C1=CC2=C(CC1)C(C)(C)c1cc(-c3ccc(C(C)(C)C)cc3)ccc12
InChIInChI=1S/C32H34/c1-21-9-7-8-10-26(21)24-14-18-29-28(19-24)27-17-13-23(20-30(27)32(29,5)6)22-11-15-25(16-12-22)31(2,3)4/h7-13,15-17,19-20H,14,18H2,1-6H3
InChIKeyYPNQNLOHHZIHSD-UHFFFAOYSA-N
MW418.62 g/mol
LogP8.88
Rot. Bonds2

About 7-(4-tert-butylphenyl)-9,9-dimethyl-3-(2-methylphenyl)-1,2-dihydrofluorene

7-(4-tert-butylphenyl)-9,9-dimethyl-3-(2-methylphenyl)-1,2-dihydrofluorene (PubChem CID 156827419) has the molecular formula C32H34 and a molecular weight of 418.62 g/mol. Its IUPAC name is 7-(4-tert-butylphenyl)-9,9-dimethyl-3-(2-methylphenyl)-1,2-dihydrofluorene.

Molecular Properties

Compound Name7-(4-tert-butylphenyl)-9,9-dimethyl-3-(2-methylphenyl)-1,2-dihydrofluorene
PubChem CID156827419
Molecular FormulaC32H34
Molecular Weight418.62 g/mol
Exact Mass418.27
IUPAC Name7-(4-tert-butylphenyl)-9,9-dimethyl-3-(2-methylphenyl)-1,2-dihydrofluorene
SMILESCc1ccccc1C1=CC2=C(CC1)C(C)(C)c1cc(-c3ccc(C(C)(C)C)cc3)ccc12
InChIInChI=1S/C32H34/c1-21-9-7-8-10-26(21)24-14-18-29-28(19-24)27-17-13-23(20-30(27)32(29,5)6)22-11-15-25(16-12-22)31(2,3)4/h7-13,15-17,19-20H,14,18H2,1-6H3
InChIKeyYPNQNLOHHZIHSD-UHFFFAOYSA-N
XLogP8.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500418.62
LogP ≤ 58.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

7-(4-tert-butylphenyl)-9,9-dimethyl-3-(2-methylphenyl)-1,2-dihydrofluorene;1-(2-ethylphenyl)-2-methyl-3-(4-propylphenyl)benzene;propane;4,9,9-trimethylfluorene
CID 156827417
2-(4-tert-butylphenyl)-9,9-dimethyl-7-(3,9,9-trimethylfluoren-2-yl)fluorene
CID 59782412
2-tert-butyl-7-[4-[9,9-dimethyl-7-(3-phenylphenyl)fluoren-2-yl]phenyl]-9,9-dimethylfluorene
CID 58881044
9,9-dimethyl-2-(2-methylphenyl)fluorene
CID 58389997
N-[4-(4-tert-butylphenyl)-2-(2-methylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine
CID 155221097
2,7-ditert-butyl-9,9-dimethyl-4-[4-[4-(4-phenylphenyl)phenyl]phenyl]fluorene
CID 58986902
2,7-ditert-butyl-9,9-dimethyl-4-[4-(4-phenylphenyl)phenyl]fluorene
CID 58986922
2,7-ditert-butyl-9,9-dimethyl-4-[4-(2-phenylphenyl)phenyl]fluorene
CID 58986957
2-[4-[4-[9,9-dimethyl-7-(2-phenylphenyl)fluoren-2-yl]phenyl]phenyl]-9,9-dimethyl-7-(2-phenylphenyl)fluorene
CID 58880971
10-(4-tert-butylphenyl)-9-(9,9-dimethylfluoren-2-yl)-2-naphthalen-2-ylanthracene
CID 59196069
2,7-ditert-butyl-4-[4-[4-[4-(2,7-ditert-butyl-9,9-dimethylfluoren-4-yl)phenyl]phenyl]phenyl]-9,9-dimethylfluorene
CID 58986985
9,9-dimethyl-2-[4-methyl-3-(2-methylcyclohexa-1,5-dien-1-yl)phenyl]fluorene
CID 145212388

Frequently Asked Questions

What is the IUPAC name of 7-(4-tert-butylphenyl)-9,9-dimethyl-3-(2-methylphenyl)-1,2-dihydrofluorene?
The IUPAC name of 7-(4-tert-butylphenyl)-9,9-dimethyl-3-(2-methylphenyl)-1,2-dihydrofluorene (CID 156827419) is 7-(4-tert-butylphenyl)-9,9-dimethyl-3-(2-methylphenyl)-1,2-dihydrofluorene.
What is the SMILES notation for 7-(4-tert-butylphenyl)-9,9-dimethyl-3-(2-methylphenyl)-1,2-dihydrofluorene?
The canonical SMILES for 7-(4-tert-butylphenyl)-9,9-dimethyl-3-(2-methylphenyl)-1,2-dihydrofluorene is Cc1ccccc1C1=CC2=C(CC1)C(C)(C)c1cc(-c3ccc(C(C)(C)C)cc3)ccc12.
What is the InChIKey of 7-(4-tert-butylphenyl)-9,9-dimethyl-3-(2-methylphenyl)-1,2-dihydrofluorene?
The InChIKey is YPNQNLOHHZIHSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H34/c1-21-9-7-8-10-26(21)24-14-18-29-28(19-24)27-17-13-23(20-30(27)32(29,5)6)22-11-15-25(16-12-22)31(2,3)4/h7-13,15-17,19-20H,14,18H2,1-6H3.
What are the key properties of 7-(4-tert-butylphenyl)-9,9-dimethyl-3-(2-methylphenyl)-1,2-dihydrofluorene?
7-(4-tert-butylphenyl)-9,9-dimethyl-3-(2-methylphenyl)-1,2-dihydrofluorene has a molecular weight of 418.62 g/mol, XLogP of 8.88, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-tert-butylphenyl)-9,9-dimethyl-3-(2-methylphenyl)-1,2-dihydrofluorene is sourced from PubChem (CID 156827419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).