1,2-dimethyl-3-(2-methylphenyl)benzene;ethane;1-methyl-9H-fluorene;1-methyl-4-[(4-methylphenyl)methyl]benzene;5,7,7,9-tetramethylbenzo[c]fluorene

C67H70 — CID 144613590

IUPAC1,2-dimethyl-3-(2-methylphenyl)benzene;ethane;1-methyl-9H-fluorene;1-methyl-4-[(4-methylphenyl)methyl]benzene;5,7,7,9-tetramethylbenzo[c]fluorene
SMILESCC.Cc1ccc(Cc2ccc(C)cc2)cc1.Cc1ccc2c(c1)C(C)(C)c1cc(C)c3ccccc3c1-2.Cc1cccc2c1Cc1ccccc1-2.Cc1ccccc1-c1cccc(C)c1C
InChIInChI=1S/C21H20.2C15H16.C14H12.C2H6/c1-13-9-10-17-18(11-13)21(3,4)19-12-14(2)15-7-5-6-8-16(15)20(17)19;1-12-3-7-14(8-4-12)11-15-9-5-13(2)6-10-15;1-11-8-6-10-15(13(11)3)14-9-5-4-7-12(14)2;1-10-5-4-8-13-12-7-3-2-6-11(12)9-14(10)13;1-2/h5-12H,1-4H3;3-10H,11H2,1-2H3;4-10H,1-3H3;2-8H,9H2,1H3;1-2H3
InChIKeyTWEKYKBMMKNTLB-UHFFFAOYSA-N
MW875.30 g/mol
LogP18.53
Rot. Bonds3

About 1,2-dimethyl-3-(2-methylphenyl)benzene;ethane;1-methyl-9H-fluorene;1-methyl-4-[(4-methylphenyl)methyl]benzene;5,7,7,9-tetramethylbenzo[c]fluorene

1,2-dimethyl-3-(2-methylphenyl)benzene;ethane;1-methyl-9H-fluorene;1-methyl-4-[(4-methylphenyl)methyl]benzene;5,7,7,9-tetramethylbenzo[c]fluorene (PubChem CID 144613590) has the molecular formula C67H70 and a molecular weight of 875.30 g/mol. Its IUPAC name is 1,2-dimethyl-3-(2-methylphenyl)benzene;ethane;1-methyl-9H-fluorene;1-methyl-4-[(4-methylphenyl)methyl]benzene;5,7,7,9-tetramethylbenzo[c]fluorene.

Molecular Properties

Compound Name1,2-dimethyl-3-(2-methylphenyl)benzene;ethane;1-methyl-9H-fluorene;1-methyl-4-[(4-methylphenyl)methyl]benzene;5,7,7,9-tetramethylbenzo[c]fluorene
PubChem CID144613590
Molecular FormulaC67H70
Molecular Weight875.30 g/mol
Exact Mass874.55
IUPAC Name1,2-dimethyl-3-(2-methylphenyl)benzene;ethane;1-methyl-9H-fluorene;1-methyl-4-[(4-methylphenyl)methyl]benzene;5,7,7,9-tetramethylbenzo[c]fluorene
SMILESCC.Cc1ccc(Cc2ccc(C)cc2)cc1.Cc1ccc2c(c1)C(C)(C)c1cc(C)c3ccccc3c1-2.Cc1cccc2c1Cc1ccccc1-2.Cc1ccccc1-c1cccc(C)c1C
InChIInChI=1S/C21H20.2C15H16.C14H12.C2H6/c1-13-9-10-17-18(11-13)21(3,4)19-12-14(2)15-7-5-6-8-16(15)20(17)19;1-12-3-7-14(8-4-12)11-15-9-5-13(2)6-10-15;1-11-8-6-10-15(13(11)3)14-9-5-4-7-12(14)2;1-10-5-4-8-13-12-7-3-2-6-11(12)9-14(10)13;1-2/h5-12H,1-4H3;3-10H,11H2,1-2H3;4-10H,1-3H3;2-8H,9H2,1H3;1-2H3
InChIKeyTWEKYKBMMKNTLB-UHFFFAOYSA-N
XLogP18.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms67
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500875.30
LogP ≤ 518.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1,2-dimethyl-3-(2-methylphenyl)benzene;ethane;1-methyl-9H-fluorene;1-methyl-4-[(4-methylphenyl)methyl]benzene;5,7,7,9-tetramethylbenzo[c]fluorene with MolForge

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Related Compounds

5,7,7,9-tetramethylbenzo[c]fluorene
CID 59595492
4-tert-butyl-2-(3-tert-butyl-3,6-dimethylcyclohexa-1,5-dien-1-yl)-1-methylbenzene;1-(2-ethenylphenyl)-2,3-dimethylbenzene;5,7,7,9-tetramethylbenzo[c]fluorene;1,4-xylene
CID 144612864
8-methyl-7H-benzo[c]fluorene;9-methyl-7H-benzo[c]fluorene;10-methyl-7H-benzo[c]fluorene;1-methyl-9H-fluorene;2-methyl-9H-fluorene;3-methyl-9H-fluorene;toluene
CID 160899257
1,4-dimethyl-2-(2-methyl-5-phenylphenyl)benzene;3-methyl-3,9-dihydro-2H-fluorene;5,7,7,9-tetramethylbenzo[c]fluorene;toluene
CID 144613972
1,2-diethyl-3-(2-methylphenyl)benzene;1-(2-methylphenyl)-2,3-di(propan-2-yl)benzene;5,7,7,9-tetramethylbenzo[c]fluorene;toluene;1,3-xylene
CID 144613457
5-(3,5-dimethylphenyl)-7,7,9-trimethylbenzo[c]fluorene;ethane;2-methyl-1-(2-methylphenyl)-4-propan-2-ylbenzene;toluene
CID 144614242
2-methyl-11,12-dihydroindeno[2,1-a]fluorene
CID 91412368
5,7,7-trimethyl-3-[[4-[3-[[4-[3-methyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]methyl]-9-(4-methylphenyl)fluoren-9-yl]phenyl]methyl]benzo[c]fluorene
CID 123592313
2,3-bis(ethenyl)-5-methyl-1-benzofuran;1-ethyl-2-(2-methylphenyl)benzene;5,7,7,9-tetramethylbenzo[c]fluorene;toluene
CID 144613327
2,4-diphenyl-6-(5,7,7-trimethylbenzo[g]fluoren-9-yl)-1,3,5-triazine
CID 169290945
ethane;1-(2-methylphenyl)-9H-fluorene;1-(3-methylphenyl)-9H-fluorene;1-methyl-8-phenyl-9H-fluorene;2-methyl-7-phenyl-9H-fluorene;3-(2-methylphenyl)-9H-fluorene;3-(3-methylphenyl)-9H-fluorene;6-methyl-1-phenyl-9H-fluorene
CID 163579670
2,12,12-trimethyl-7H-indeno[1,2-a]fluorene
CID 142054010

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-3-(2-methylphenyl)benzene;ethane;1-methyl-9H-fluorene;1-methyl-4-[(4-methylphenyl)methyl]benzene;5,7,7,9-tetramethylbenzo[c]fluorene?
The IUPAC name of 1,2-dimethyl-3-(2-methylphenyl)benzene;ethane;1-methyl-9H-fluorene;1-methyl-4-[(4-methylphenyl)methyl]benzene;5,7,7,9-tetramethylbenzo[c]fluorene (CID 144613590) is 1,2-dimethyl-3-(2-methylphenyl)benzene;ethane;1-methyl-9H-fluorene;1-methyl-4-[(4-methylphenyl)methyl]benzene;5,7,7,9-tetramethylbenzo[c]fluorene.
What is the SMILES notation for 1,2-dimethyl-3-(2-methylphenyl)benzene;ethane;1-methyl-9H-fluorene;1-methyl-4-[(4-methylphenyl)methyl]benzene;5,7,7,9-tetramethylbenzo[c]fluorene?
The canonical SMILES for 1,2-dimethyl-3-(2-methylphenyl)benzene;ethane;1-methyl-9H-fluorene;1-methyl-4-[(4-methylphenyl)methyl]benzene;5,7,7,9-tetramethylbenzo[c]fluorene is CC.Cc1ccc(Cc2ccc(C)cc2)cc1.Cc1ccc2c(c1)C(C)(C)c1cc(C)c3ccccc3c1-2.Cc1cccc2c1Cc1ccccc1-2.Cc1ccccc1-c1cccc(C)c1C.
What is the InChIKey of 1,2-dimethyl-3-(2-methylphenyl)benzene;ethane;1-methyl-9H-fluorene;1-methyl-4-[(4-methylphenyl)methyl]benzene;5,7,7,9-tetramethylbenzo[c]fluorene?
The InChIKey is TWEKYKBMMKNTLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20.2C15H16.C14H12.C2H6/c1-13-9-10-17-18(11-13)21(3,4)19-12-14(2)15-7-5-6-8-16(15)20(17)19;1-12-3-7-14(8-4-12)11-15-9-5-13(2)6-10-15;1-11-8-6-10-15(13(11)3)14-9-5-4-7-12(14)2;1-10-5-4-8-13-12-7-3-2-6-11(12)9-14(10)13;1-2/h5-12H,1-4H3;3-10H,11H2,1-2H3;4-10H,1-3H3;2-8H,9H2,1H3;1-2H3.
What are the key properties of 1,2-dimethyl-3-(2-methylphenyl)benzene;ethane;1-methyl-9H-fluorene;1-methyl-4-[(4-methylphenyl)methyl]benzene;5,7,7,9-tetramethylbenzo[c]fluorene?
1,2-dimethyl-3-(2-methylphenyl)benzene;ethane;1-methyl-9H-fluorene;1-methyl-4-[(4-methylphenyl)methyl]benzene;5,7,7,9-tetramethylbenzo[c]fluorene has a molecular weight of 875.30 g/mol, XLogP of 18.53, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-3-(2-methylphenyl)benzene;ethane;1-methyl-9H-fluorene;1-methyl-4-[(4-methylphenyl)methyl]benzene;5,7,7,9-tetramethylbenzo[c]fluorene is sourced from PubChem (CID 144613590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).