11,11-dimethylbenzo[a]fluorene;ethane

C21H22 — CID 144938734

IUPAC11,11-dimethylbenzo[a]fluorene;ethane
SMILESCC.CC1(C)c2ccccc2-c2ccc3ccccc3c21
InChIInChI=1S/C19H16.C2H6/c1-19(2)17-10-6-5-9-15(17)16-12-11-13-7-3-4-8-14(13)18(16)19;1-2/h3-12H,1-2H3;1-2H3
InChIKeyYYBQPLJKUOSKET-UHFFFAOYSA-N
MW274.41 g/mol
LogP6.17
Rot. Bonds

About 11,11-dimethylbenzo[a]fluorene;ethane

11,11-dimethylbenzo[a]fluorene;ethane (PubChem CID 144938734) has the molecular formula C21H22 and a molecular weight of 274.41 g/mol. Its IUPAC name is 11,11-dimethylbenzo[a]fluorene;ethane.

Molecular Properties

Compound Name11,11-dimethylbenzo[a]fluorene;ethane
PubChem CID144938734
Molecular FormulaC21H22
Molecular Weight274.41 g/mol
Exact Mass274.17
IUPAC Name11,11-dimethylbenzo[a]fluorene;ethane
SMILESCC.CC1(C)c2ccccc2-c2ccc3ccccc3c21
InChIInChI=1S/C19H16.C2H6/c1-19(2)17-10-6-5-9-15(17)16-12-11-13-7-3-4-8-14(13)18(16)19;1-2/h3-12H,1-2H3;1-2H3
InChIKeyYYBQPLJKUOSKET-UHFFFAOYSA-N
XLogP6.17
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.41
LogP ≤ 56.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

11,11-dimethylindeno[2,1-a]phenanthrene;ethane
CID 144670680
11,11-dimethylindeno[2,1-a]phenanthrene;ethane
CID 91470717
9,9-dimethyl-1-naphthalen-1-ylfluorene
CID 144938636
11,11-dimethylbenzo[a]fluoren-9-ol
CID 129259238
11,11-dimethyl-9-naphthalen-2-ylbenzo[a]fluorene
CID 144938907
5-(9,9-dimethylfluoren-1-yl)benzo[c]phenanthrene
CID 140710620
ethane;ethene;3,11,11-trimethylindeno[2,1-a]phenanthrene
CID 144670692
2-(11,11-dimethylbenzo[a]fluoren-3-yl)-4,6-dinaphthalen-1-ylpyrimidine
CID 155465661
11,11-dimethylbenzo[a]fluorene;11,11-dimethylbenzo[b]fluorene;7,7-dimethylbenzo[c]fluorene;9,9-dimethylfluorene;8,8-dimethylindeno[1,2-a]anthracene;13,13-dimethylindeno[2,1-a]anthracene;10,10-dimethylpentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(21),2,4,6,8,11,13,15,17,19-decaene;ethane
CID 159108274
8-[9,10-bis(9,9-dimethylfluoren-2-yl)anthracen-2-yl]-11,11-dimethylbenzo[a]fluorene
CID 140724296
7-chloro-11,11-dimethylbenzo[a]fluorene
CID 159699272
11,11-dimethyl-9-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]benzo[a]fluorene
CID 144583230

Frequently Asked Questions

What is the IUPAC name of 11,11-dimethylbenzo[a]fluorene;ethane?
The IUPAC name of 11,11-dimethylbenzo[a]fluorene;ethane (CID 144938734) is 11,11-dimethylbenzo[a]fluorene;ethane.
What is the SMILES notation for 11,11-dimethylbenzo[a]fluorene;ethane?
The canonical SMILES for 11,11-dimethylbenzo[a]fluorene;ethane is CC.CC1(C)c2ccccc2-c2ccc3ccccc3c21.
What is the InChIKey of 11,11-dimethylbenzo[a]fluorene;ethane?
The InChIKey is YYBQPLJKUOSKET-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16.C2H6/c1-19(2)17-10-6-5-9-15(17)16-12-11-13-7-3-4-8-14(13)18(16)19;1-2/h3-12H,1-2H3;1-2H3.
What are the key properties of 11,11-dimethylbenzo[a]fluorene;ethane?
11,11-dimethylbenzo[a]fluorene;ethane has a molecular weight of 274.41 g/mol, XLogP of 6.17, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 11,11-dimethylbenzo[a]fluorene;ethane is sourced from PubChem (CID 144938734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).