ethane;methane;2,9,9-trimethylfluorene

C21H34 — CID 144920604

IUPACethane;methane;2,9,9-trimethylfluorene
SMILESC.C.C.CC.Cc1ccc2c(c1)C(C)(C)c1ccccc1-2
InChIInChI=1S/C16H16.C2H6.3CH4/c1-11-8-9-13-12-6-4-5-7-14(12)16(2,3)15(13)10-11;1-2;;;/h4-10H,1-3H3;1-2H3;3*1H4
InChIKeyIMKDYHYLBFFHAI-UHFFFAOYSA-N
MW286.50 g/mol
LogP7.24
Rot. Bonds

About ethane;methane;2,9,9-trimethylfluorene

ethane;methane;2,9,9-trimethylfluorene (PubChem CID 144920604) has the molecular formula C21H34 and a molecular weight of 286.50 g/mol. Its IUPAC name is ethane;methane;2,9,9-trimethylfluorene.

Molecular Properties

Compound Nameethane;methane;2,9,9-trimethylfluorene
PubChem CID144920604
Molecular FormulaC21H34
Molecular Weight286.50 g/mol
Exact Mass286.27
IUPAC Nameethane;methane;2,9,9-trimethylfluorene
SMILESC.C.C.CC.Cc1ccc2c(c1)C(C)(C)c1ccccc1-2
InChIInChI=1S/C16H16.C2H6.3CH4/c1-11-8-9-13-12-6-4-5-7-14(12)16(2,3)15(13)10-11;1-2;;;/h4-10H,1-3H3;1-2H3;3*1H4
InChIKeyIMKDYHYLBFFHAI-UHFFFAOYSA-N
XLogP7.24
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500286.50
LogP ≤ 57.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-methylnaphthalene;2,9,9-trimethylfluorene
CID 144639676
2,7,9,9-tetramethylfluorene
CID 22951928
N-(9,9-dimethylfluoren-2-yl)-7,9,9-trimethyl-N-(7,9,9-trimethylfluoren-2-yl)fluoren-2-amine
CID 151367226
9,9-dimethyl-2-(3-methylphenyl)fluorene;ethane;methane
CID 144583357
2',9,9-trimethylspiro[anthracene-10,9'-fluorene]
CID 142504500
ethane;6,6,12,12-tetramethyl-2-(4-methylphenyl)indeno[1,2-b]fluorene
CID 144585060
2,6,9,9-tetramethylfluorene
CID 23527438
N,N-bis(9,9-dimethylfluoren-3-yl)-7,9,9-trimethylfluoren-2-amine
CID 163882146
6,6,12,12-tetramethyl-2-(4-methylphenyl)indeno[1,2-b]fluorene
CID 144585061
2,2',7'-trimethyl-9,9'-spirobi[fluorene]
CID 20807057
ethane;1-ethyl-4-phenylbenzene;2,6,6,8,12,12-hexamethylindeno[1,2-b]fluorene;1-methyl-4-phenylbenzene;toluene;2,9,9-trimethylfluorene
CID 143843948
9,9-dimethyl-N,N-bis(4-methylphenyl)fluoren-2-amine
CID 11111910

Frequently Asked Questions

What is the IUPAC name of ethane;methane;2,9,9-trimethylfluorene?
The IUPAC name of ethane;methane;2,9,9-trimethylfluorene (CID 144920604) is ethane;methane;2,9,9-trimethylfluorene.
What is the SMILES notation for ethane;methane;2,9,9-trimethylfluorene?
The canonical SMILES for ethane;methane;2,9,9-trimethylfluorene is C.C.C.CC.Cc1ccc2c(c1)C(C)(C)c1ccccc1-2.
What is the InChIKey of ethane;methane;2,9,9-trimethylfluorene?
The InChIKey is IMKDYHYLBFFHAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16.C2H6.3CH4/c1-11-8-9-13-12-6-4-5-7-14(12)16(2,3)15(13)10-11;1-2;;;/h4-10H,1-3H3;1-2H3;3*1H4.
What are the key properties of ethane;methane;2,9,9-trimethylfluorene?
ethane;methane;2,9,9-trimethylfluorene has a molecular weight of 286.50 g/mol, XLogP of 7.24, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;methane;2,9,9-trimethylfluorene is sourced from PubChem (CID 144920604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).