4-bromo-2-(2-methylpropyl)dibenzofuran

C16H15BrO — CID 166913108

IUPAC4-bromo-2-(2-methylpropyl)dibenzofuran
SMILESCC(C)Cc1cc(Br)c2oc3ccccc3c2c1
InChIInChI=1S/C16H15BrO/c1-10(2)7-11-8-13-12-5-3-4-6-15(12)18-16(13)14(17)9-11/h3-6,8-10H,7H2,1-2H3
InChIKeyRHPGAWKGBQXOGU-UHFFFAOYSA-N
MW303.20 g/mol
LogP5.55
Rot. Bonds2

About 4-bromo-2-(2-methylpropyl)dibenzofuran

4-bromo-2-(2-methylpropyl)dibenzofuran (PubChem CID 166913108) has the molecular formula C16H15BrO and a molecular weight of 303.20 g/mol. Its IUPAC name is 4-bromo-2-(2-methylpropyl)dibenzofuran.

Molecular Properties

Compound Name4-bromo-2-(2-methylpropyl)dibenzofuran
PubChem CID166913108
Molecular FormulaC16H15BrO
Molecular Weight303.20 g/mol
Exact Mass302.03
IUPAC Name4-bromo-2-(2-methylpropyl)dibenzofuran
SMILESCC(C)Cc1cc(Br)c2oc3ccccc3c2c1
InChIInChI=1S/C16H15BrO/c1-10(2)7-11-8-13-12-5-3-4-6-15(12)18-16(13)14(17)9-11/h3-6,8-10H,7H2,1-2H3
InChIKeyRHPGAWKGBQXOGU-UHFFFAOYSA-N
XLogP5.55
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500303.20
LogP ≤ 55.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-bromo-2-propan-2-yldibenzofuran
CID 166912960
2-(2-methylpropyl)dibenzofuran
CID 59877560
3-[2-(2-methylpropyl)dibenzofuran-4-yl]benzo[f]quinoline
CID 140916453
4-bromodibenzofuran-2-amine
CID 122462972
1,3-dibromo-5-(2-methylpropyl)-2-phenylmethoxybenzene
CID 164892875
1-dibenzofuran-2-ylpropan-2-amine
CID 42647881
[2-(2,3-dimethyldibenzofuran-4-yl)-1-methyl-6-(2-methylpropyl)quinolin-1-ium-4-yl]-trimethylsilane
CID 164807728
6-cyclopentyl-1-[2-(2-methylpropyl)dibenzofuran-4-yl]isoquinoline
CID 166913046
7-bromo-N-methyl-5-(2-methylpropyl)-1,3-benzoxazol-2-amine
CID 82233713
(4-bromodibenzofuran-2-yl)oxy-diphenylphosphane
CID 141477714
4-bromo-6-dibenzofuran-4-yldibenzofuran
CID 147905511
4-benzyl-2-[5-methyl-4-(2-methylpropyl)-2-pyridinyl]-[1]benzofuro[3,2-b]pyridine
CID 162708647

Frequently Asked Questions

What is the IUPAC name of 4-bromo-2-(2-methylpropyl)dibenzofuran?
The IUPAC name of 4-bromo-2-(2-methylpropyl)dibenzofuran (CID 166913108) is 4-bromo-2-(2-methylpropyl)dibenzofuran.
What is the SMILES notation for 4-bromo-2-(2-methylpropyl)dibenzofuran?
The canonical SMILES for 4-bromo-2-(2-methylpropyl)dibenzofuran is CC(C)Cc1cc(Br)c2oc3ccccc3c2c1.
What is the InChIKey of 4-bromo-2-(2-methylpropyl)dibenzofuran?
The InChIKey is RHPGAWKGBQXOGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15BrO/c1-10(2)7-11-8-13-12-5-3-4-6-15(12)18-16(13)14(17)9-11/h3-6,8-10H,7H2,1-2H3.
What are the key properties of 4-bromo-2-(2-methylpropyl)dibenzofuran?
4-bromo-2-(2-methylpropyl)dibenzofuran has a molecular weight of 303.20 g/mol, XLogP of 5.55, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-2-(2-methylpropyl)dibenzofuran is sourced from PubChem (CID 166913108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).