6-bromo-11,11-dimethylbenzo[a]fluorene

C19H15Br — CID 155318624

IUPAC6-bromo-11,11-dimethylbenzo[a]fluorene
SMILESCC1(C)c2ccccc2-c2c(Br)cc3ccccc3c21
InChIInChI=1S/C19H15Br/c1-19(2)15-10-6-5-9-14(15)17-16(20)11-12-7-3-4-8-13(12)18(17)19/h3-11H,1-2H3
InChIKeyXNMXGTXENWIDCX-UHFFFAOYSA-N
MW323.23 g/mol
LogP5.91
Rot. Bonds

About 6-bromo-11,11-dimethylbenzo[a]fluorene

6-bromo-11,11-dimethylbenzo[a]fluorene (PubChem CID 155318624) has the molecular formula C19H15Br and a molecular weight of 323.23 g/mol. Its IUPAC name is 6-bromo-11,11-dimethylbenzo[a]fluorene.

Molecular Properties

Compound Name6-bromo-11,11-dimethylbenzo[a]fluorene
PubChem CID155318624
Molecular FormulaC19H15Br
Molecular Weight323.23 g/mol
Exact Mass322.04
IUPAC Name6-bromo-11,11-dimethylbenzo[a]fluorene
SMILESCC1(C)c2ccccc2-c2c(Br)cc3ccccc3c21
InChIInChI=1S/C19H15Br/c1-19(2)15-10-6-5-9-14(15)17-16(20)11-12-7-3-4-8-13(12)18(17)19/h3-11H,1-2H3
InChIKeyXNMXGTXENWIDCX-UHFFFAOYSA-N
XLogP5.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500323.23
LogP ≤ 55.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

8,8-dimethylhexacyclo[15.7.1.02,7.09,25.010,15.019,24]pentacosa-1(25),2,4,6,9,11,13,15,17,19,21,23-dodecaene
CID 123897654
N-(11,11-dimethylbenzo[a]fluoren-6-yl)-11,11-dimethyl-N-phenanthren-9-ylbenzo[a]fluoren-6-amine
CID 164929478
2-(11,11-dimethylbenzo[a]fluoren-6-yl)-4,6-diphenylpyrimidine
CID 165151962
4-(11,11-dimethylbenzo[a]fluoren-6-yl)-2,6-diphenylpyridine
CID 165152145
2-[4-(11,11-dimethylbenzo[a]fluoren-6-yl)phenyl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 165152188
2-[3-(11,11-dimethylbenzo[a]fluoren-6-yl)phenyl]-4,6-bis(3-phenylphenyl)-1,3,5-triazine
CID 165151926
N-[4-[4-(11,11-dimethylbenzo[a]fluoren-6-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 164929419
4-(11,11-dimethylbenzo[a]fluoren-6-yl)-N,N-diphenylnaphthalen-1-amine
CID 170412509
N-(11,11-dimethylbenzo[a]fluoren-6-yl)-11,11-dimethyl-N-[4-(4-phenylphenyl)phenyl]benzo[a]fluoren-6-amine
CID 164929320
4-[3-(11,11-dimethylbenzo[a]fluoren-6-yl)phenyl]-2,6-bis(3-phenylphenyl)pyridine
CID 165152303
2-[3-[3-(11,11-dimethylbenzo[a]fluoren-6-yl)phenyl]phenyl]-4,6-diphenylpyrimidine
CID 165152040
4-(11,11-dimethylbenzo[a]fluoren-6-yl)-2-(3,5-diphenylphenyl)-6-phenylpyridine
CID 165152041

Frequently Asked Questions

What is the IUPAC name of 6-bromo-11,11-dimethylbenzo[a]fluorene?
The IUPAC name of 6-bromo-11,11-dimethylbenzo[a]fluorene (CID 155318624) is 6-bromo-11,11-dimethylbenzo[a]fluorene.
What is the SMILES notation for 6-bromo-11,11-dimethylbenzo[a]fluorene?
The canonical SMILES for 6-bromo-11,11-dimethylbenzo[a]fluorene is CC1(C)c2ccccc2-c2c(Br)cc3ccccc3c21.
What is the InChIKey of 6-bromo-11,11-dimethylbenzo[a]fluorene?
The InChIKey is XNMXGTXENWIDCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15Br/c1-19(2)15-10-6-5-9-14(15)17-16(20)11-12-7-3-4-8-13(12)18(17)19/h3-11H,1-2H3.
What are the key properties of 6-bromo-11,11-dimethylbenzo[a]fluorene?
6-bromo-11,11-dimethylbenzo[a]fluorene has a molecular weight of 323.23 g/mol, XLogP of 5.91, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-11,11-dimethylbenzo[a]fluorene is sourced from PubChem (CID 155318624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).