ethane;6,6,12,12-tetramethyl-2-(4-methylphenyl)indeno[1,2-b]fluorene

C33H34 — CID 144585060

IUPACethane;6,6,12,12-tetramethyl-2-(4-methylphenyl)indeno[1,2-b]fluorene
SMILESCC.Cc1ccc(-c2ccc3c(c2)C(C)(C)c2cc4c(cc2-3)C(C)(C)c2ccccc2-4)cc1
InChIInChI=1S/C31H28.C2H6/c1-19-10-12-20(13-11-19)21-14-15-23-25-18-28-24(17-29(25)31(4,5)27(23)16-21)22-8-6-7-9-26(22)30(28,2)3;1-2/h6-18H,1-5H3;1-2H3
InChIKeyIUGMXDUAUNWWAX-UHFFFAOYSA-N
MW430.64 g/mol
LogP9.30
Rot. Bonds1

About ethane;6,6,12,12-tetramethyl-2-(4-methylphenyl)indeno[1,2-b]fluorene

ethane;6,6,12,12-tetramethyl-2-(4-methylphenyl)indeno[1,2-b]fluorene (PubChem CID 144585060) has the molecular formula C33H34 and a molecular weight of 430.64 g/mol. Its IUPAC name is ethane;6,6,12,12-tetramethyl-2-(4-methylphenyl)indeno[1,2-b]fluorene.

Molecular Properties

Compound Nameethane;6,6,12,12-tetramethyl-2-(4-methylphenyl)indeno[1,2-b]fluorene
PubChem CID144585060
Molecular FormulaC33H34
Molecular Weight430.64 g/mol
Exact Mass430.27
IUPAC Nameethane;6,6,12,12-tetramethyl-2-(4-methylphenyl)indeno[1,2-b]fluorene
SMILESCC.Cc1ccc(-c2ccc3c(c2)C(C)(C)c2cc4c(cc2-3)C(C)(C)c2ccccc2-4)cc1
InChIInChI=1S/C31H28.C2H6/c1-19-10-12-20(13-11-19)21-14-15-23-25-18-28-24(17-29(25)31(4,5)27(23)16-21)22-8-6-7-9-26(22)30(28,2)3;1-2/h6-18H,1-5H3;1-2H3
InChIKeyIUGMXDUAUNWWAX-UHFFFAOYSA-N
XLogP9.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500430.64
LogP ≤ 59.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

6,6,12,12-tetramethyl-2-(4-methylphenyl)indeno[1,2-b]fluorene
CID 144585061
9,9-dimethyl-2-(4-methylphenyl)fluorene;1-methyl-4-phenylbenzene;2,6,6,12,12-pentamethyl-7-phenylindeno[1,2-b]fluorene
CID 142541100
2-[3,5-bis[7-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]phenyl]-7-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluorene
CID 101336380
2,7-bis[3,5-bis[3,5-bis(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-9,9-dimethylfluorene
CID 58881238
9,9-dimethyl-2-(3-methylphenyl)fluorene;ethane;methane
CID 144583357
9,9-dimethyl-3-[3-[4-(4-methylphenyl)phenyl]phenyl]fluorene
CID 156827523
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N,3,5-trimethylaniline;ethane
CID 143983290
ethane;methane;2,9,9-trimethylfluorene
CID 144920604
4-(9,9-dimethylfluoren-2-yl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]aniline;ethane
CID 143972766
3,9,9-trimethyl-2,7-bis(3,9,9-trimethylfluoren-2-yl)fluorene
CID 59782429
CID 143619792
CID 143619792
1-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2,5-bis(4-methylphenyl)pyrrole
CID 58489457

Frequently Asked Questions

What is the IUPAC name of ethane;6,6,12,12-tetramethyl-2-(4-methylphenyl)indeno[1,2-b]fluorene?
The IUPAC name of ethane;6,6,12,12-tetramethyl-2-(4-methylphenyl)indeno[1,2-b]fluorene (CID 144585060) is ethane;6,6,12,12-tetramethyl-2-(4-methylphenyl)indeno[1,2-b]fluorene.
What is the SMILES notation for ethane;6,6,12,12-tetramethyl-2-(4-methylphenyl)indeno[1,2-b]fluorene?
The canonical SMILES for ethane;6,6,12,12-tetramethyl-2-(4-methylphenyl)indeno[1,2-b]fluorene is CC.Cc1ccc(-c2ccc3c(c2)C(C)(C)c2cc4c(cc2-3)C(C)(C)c2ccccc2-4)cc1.
What is the InChIKey of ethane;6,6,12,12-tetramethyl-2-(4-methylphenyl)indeno[1,2-b]fluorene?
The InChIKey is IUGMXDUAUNWWAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H28.C2H6/c1-19-10-12-20(13-11-19)21-14-15-23-25-18-28-24(17-29(25)31(4,5)27(23)16-21)22-8-6-7-9-26(22)30(28,2)3;1-2/h6-18H,1-5H3;1-2H3.
What are the key properties of ethane;6,6,12,12-tetramethyl-2-(4-methylphenyl)indeno[1,2-b]fluorene?
ethane;6,6,12,12-tetramethyl-2-(4-methylphenyl)indeno[1,2-b]fluorene has a molecular weight of 430.64 g/mol, XLogP of 9.30, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;6,6,12,12-tetramethyl-2-(4-methylphenyl)indeno[1,2-b]fluorene is sourced from PubChem (CID 144585060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).