2-(3-bromo-5-methylphenyl)dibenzofuran

C19H13BrO — CID 121368269

IUPAC2-(3-bromo-5-methylphenyl)dibenzofuran
SMILESCc1cc(Br)cc(-c2ccc3oc4ccccc4c3c2)c1
InChIInChI=1S/C19H13BrO/c1-12-8-14(10-15(20)9-12)13-6-7-19-17(11-13)16-4-2-3-5-18(16)21-19/h2-11H,1H3
InChIKeyBSKPSQUYPVABMT-UHFFFAOYSA-N
MW337.22 g/mol
LogP6.32
Rot. Bonds1

About 2-(3-bromo-5-methylphenyl)dibenzofuran

2-(3-bromo-5-methylphenyl)dibenzofuran (PubChem CID 121368269) has the molecular formula C19H13BrO and a molecular weight of 337.22 g/mol. Its IUPAC name is 2-(3-bromo-5-methylphenyl)dibenzofuran.

Molecular Properties

Compound Name2-(3-bromo-5-methylphenyl)dibenzofuran
PubChem CID121368269
Molecular FormulaC19H13BrO
Molecular Weight337.22 g/mol
Exact Mass336.01
IUPAC Name2-(3-bromo-5-methylphenyl)dibenzofuran
SMILESCc1cc(Br)cc(-c2ccc3oc4ccccc4c3c2)c1
InChIInChI=1S/C19H13BrO/c1-12-8-14(10-15(20)9-12)13-6-7-19-17(11-13)16-4-2-3-5-18(16)21-19/h2-11H,1H3
InChIKeyBSKPSQUYPVABMT-UHFFFAOYSA-N
XLogP6.32
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500337.22
LogP ≤ 56.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-[3-dibenzofuran-2-yl-5-[7-[3,5-di(dibenzofuran-2-yl)phenyl]triphenylen-2-yl]phenyl]dibenzofuran
CID 118490746
4-(3-bromo-5-dibenzofuran-2-ylphenyl)-6-dibenzofuran-2-yl-2-phenylpyrimidine
CID 147753692
N-(4-dibenzofuran-2-ylphenyl)-N-[4-[4-(N-(4-dibenzofuran-2-ylphenyl)-4-methylanilino)phenyl]phenyl]-4-methylaniline
CID 59022088
9-(2-dibenzofuran-2-ylphenyl)-3,6-bis(3,5-dimethylphenyl)carbazole
CID 169284782
2-(3-bromophenyl)-4,6-di(dibenzofuran-2-yl)-1,3,5-triazine
CID 156754970
2-(7-methylphenanthren-2-yl)dibenzofuran
CID 118887116
6-(3-bromo-5-dibenzofuran-2-ylphenyl)-N,N-diphenylnaphthalen-2-amine
CID 121443813
3-[4-[4-(4-methylphenyl)phenyl]phenyl]dibenzofuran
CID 67964733
2-(8-bromodibenzothiophen-2-yl)dibenzofuran
CID 146301047
2-[3-(3-bromophenyl)phenyl]-4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazine
CID 155203519
ethane;2-(3-methylphenyl)-8-phenyldibenzofuran
CID 143904784
3-(3-methylphenyl)dibenzofuran
CID 70924364

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromo-5-methylphenyl)dibenzofuran?
The IUPAC name of 2-(3-bromo-5-methylphenyl)dibenzofuran (CID 121368269) is 2-(3-bromo-5-methylphenyl)dibenzofuran.
What is the SMILES notation for 2-(3-bromo-5-methylphenyl)dibenzofuran?
The canonical SMILES for 2-(3-bromo-5-methylphenyl)dibenzofuran is Cc1cc(Br)cc(-c2ccc3oc4ccccc4c3c2)c1.
What is the InChIKey of 2-(3-bromo-5-methylphenyl)dibenzofuran?
The InChIKey is BSKPSQUYPVABMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13BrO/c1-12-8-14(10-15(20)9-12)13-6-7-19-17(11-13)16-4-2-3-5-18(16)21-19/h2-11H,1H3.
What are the key properties of 2-(3-bromo-5-methylphenyl)dibenzofuran?
2-(3-bromo-5-methylphenyl)dibenzofuran has a molecular weight of 337.22 g/mol, XLogP of 6.32, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromo-5-methylphenyl)dibenzofuran is sourced from PubChem (CID 121368269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).