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

C75H84 — CID 156827417

IUPAC7-(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
SMILESCCC.CCCc1ccc(-c2cccc(-c3ccccc3CC)c2C)cc1.Cc1cccc2c1-c1ccccc1C2(C)C.Cc1ccccc1C1=CC2=C(CC1)C(C)(C)c1cc(-c3ccc(C(C)(C)C)cc3)ccc12
InChIInChI=1S/C32H34.C24H26.C16H16.C3H8/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;1-4-9-19-14-16-21(17-15-19)22-12-8-13-23(18(22)3)24-11-7-6-10-20(24)5-2;1-11-7-6-10-14-15(11)12-8-4-5-9-13(12)16(14,2)3;1-3-2/h7-13,15-17,19-20H,14,18H2,1-6H3;6-8,10-17H,4-5,9H2,1-3H3;4-10H,1-3H3;3H2,1-2H3
InChIKeySNZCSCXTTGAWLF-UHFFFAOYSA-N
MW985.50 g/mol
LogP21.44
Rot. Bonds7

About 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

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 (PubChem CID 156827417) has the molecular formula C75H84 and a molecular weight of 985.50 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name7-(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
PubChem CID156827417
Molecular FormulaC75H84
Molecular Weight985.50 g/mol
Exact Mass984.66
IUPAC Name7-(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
SMILESCCC.CCCc1ccc(-c2cccc(-c3ccccc3CC)c2C)cc1.Cc1cccc2c1-c1ccccc1C2(C)C.Cc1ccccc1C1=CC2=C(CC1)C(C)(C)c1cc(-c3ccc(C(C)(C)C)cc3)ccc12
InChIInChI=1S/C32H34.C24H26.C16H16.C3H8/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;1-4-9-19-14-16-21(17-15-19)22-12-8-13-23(18(22)3)24-11-7-6-10-20(24)5-2;1-11-7-6-10-14-15(11)12-8-4-5-9-13(12)16(14,2)3;1-3-2/h7-13,15-17,19-20H,14,18H2,1-6H3;6-8,10-17H,4-5,9H2,1-3H3;4-10H,1-3H3;3H2,1-2H3
InChIKeySNZCSCXTTGAWLF-UHFFFAOYSA-N
XLogP21.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms75
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500985.50
LogP ≤ 521.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 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 with MolForge

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Related Compounds

7-(4-tert-butylphenyl)-9,9-dimethyl-3-(2-methylphenyl)-1,2-dihydrofluorene
CID 156827419
2-(4-tert-butylphenyl)-9,9-dimethyl-7-(3,9,9-trimethylfluoren-2-yl)fluorene
CID 59782412
9,9-dimethyl-7-[3-methyl-2-[2-methyl-3-(2-methylphenyl)phenyl]phenyl]-N-[4-methyl-3-(2-propylphenyl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 145354424
9-cyclohexa-1,3-dien-1-yl-9-phenyl-3-[3-(2-propylphenyl)phenyl]-1,2-dihydrofluorene;9-methyl-6-(4-methylphenyl)-2,9-dihydro-1H-fluorene;4,9,9-trimethylfluorene
CID 156827380
1-[3-(9,9-dimethylfluoren-2-yl)-2-methylphenyl]-10-propylphenanthrene
CID 144681180
N-[4-(4-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-2-amine
CID 165384797
N-[4-(2,7-ditert-butyl-9,9-dimethylfluoren-4-yl)phenyl]-N-[4-(9,9-dimethylfluoren-4-yl)phenyl]-4-phenylaniline
CID 176836108
N,N-bis(4-tert-butylphenyl)-3,5-bis(9,9-dimethylfluoren-2-yl)-4-methylaniline
CID 58389703
9,9-dimethyl-2-(3-methylphenyl)fluorene;9,9-dimethyl-2-(4-methylphenyl)fluorene;1,9,9-trimethylfluorene;3,9,9-trimethylfluorene;4,9,9-trimethylfluorene;1,9,9-trimethyl-7-phenylfluorene;6,9,9-trimethyl-2-phenylfluorene
CID 159835700
ethane;4,9,9-trimethylfluorene
CID 123917181
1-tert-butyl-4-(4-methylphenyl)benzene;2-methylanthracene;9-methylanthracene;6-methylchrysene;2-(4-methylphenyl)phenanthrene;1-methyl-4-(2-phenylphenyl)benzene;2,9,9-trimethylfluorene;3,9,9-trimethylfluorene;4,9,9-trimethylfluorene;trimethyl-[4-(4-methylphenyl)phenyl]silane
CID 159124670
3-[3-[4-(9,9-dimethylfluoren-2-yl)sulfanylphenyl]-2-methylphenyl]-4,9,9-trimethylfluorene
CID 144660569

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is CCC.CCCc1ccc(-c2cccc(-c3ccccc3CC)c2C)cc1.Cc1cccc2c1-c1ccccc1C2(C)C.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;1-(2-ethylphenyl)-2-methyl-3-(4-propylphenyl)benzene;propane;4,9,9-trimethylfluorene?
The InChIKey is SNZCSCXTTGAWLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H34.C24H26.C16H16.C3H8/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;1-4-9-19-14-16-21(17-15-19)22-12-8-13-23(18(22)3)24-11-7-6-10-20(24)5-2;1-11-7-6-10-14-15(11)12-8-4-5-9-13(12)16(14,2)3;1-3-2/h7-13,15-17,19-20H,14,18H2,1-6H3;6-8,10-17H,4-5,9H2,1-3H3;4-10H,1-3H3;3H2,1-2H3.
What are the key properties of 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?
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 has a molecular weight of 985.50 g/mol, XLogP of 21.44, 7 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;1-(2-ethylphenyl)-2-methyl-3-(4-propylphenyl)benzene;propane;4,9,9-trimethylfluorene is sourced from PubChem (CID 156827417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).