2-(2,4-dibromophenoxy)-1,3-oxazole

C9H5Br2NO2 — CID 68870605

IUPAC2-(2,4-dibromophenoxy)-1,3-oxazole
SMILESBrc1ccc(Oc2ncco2)c(Br)c1
InChIInChI=1S/C9H5Br2NO2/c10-6-1-2-8(7(11)5-6)14-9-12-3-4-13-9/h1-5H
InChIKeyCPJXZIOKKXRKEC-UHFFFAOYSA-N
MW318.95 g/mol
LogP3.99
Rot. Bonds2

About 2-(2,4-dibromophenoxy)-1,3-oxazole

2-(2,4-dibromophenoxy)-1,3-oxazole (PubChem CID 68870605) has the molecular formula C9H5Br2NO2 and a molecular weight of 318.95 g/mol. Its IUPAC name is 2-(2,4-dibromophenoxy)-1,3-oxazole.

Molecular Properties

Compound Name2-(2,4-dibromophenoxy)-1,3-oxazole
PubChem CID68870605
Molecular FormulaC9H5Br2NO2
Molecular Weight318.95 g/mol
Exact Mass316.87
IUPAC Name2-(2,4-dibromophenoxy)-1,3-oxazole
SMILESBrc1ccc(Oc2ncco2)c(Br)c1
InChIInChI=1S/C9H5Br2NO2/c10-6-1-2-8(7(11)5-6)14-9-12-3-4-13-9/h1-5H
InChIKeyCPJXZIOKKXRKEC-UHFFFAOYSA-N
XLogP3.99
TPSA35.26 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.95
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(2,4-dibromophenoxy)pyrimidin-2-yl]hydrazine
CID 80922224
2-chloro-3-(2,4-dibromophenoxy)pyrazine
CID 64719536
2-(2,5-difluorophenoxy)-1,3-oxazole
CID 91062877
1,4-dibromo-2-(2,4-dibromophenoxy)benzene
CID 15509892
3-(2,4-dibromophenoxy)pyridin-2-amine
CID 67485564
5-chloro-2-(2,4-dibromophenoxy)pyridine
CID 66232099
5-bromo-2-(2,4-dibromophenoxy)-4-methoxypyrimidine
CID 106999331
4-(2,4-dibromophenoxy)-5-iodopyrimidine
CID 66319605
1,2,3-tribromo-5-(2,4-dibromophenoxy)benzene
CID 86208553
[5-[(2,4-dibromophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine
CID 79765443
2-(2,4-dibromophenoxy)pyrimidine-4-carbothioamide
CID 107548659
[5-bromo-2-(2,4-dibromophenoxy)-3-pyridinyl]methanamine
CID 64721342

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dibromophenoxy)-1,3-oxazole?
The IUPAC name of 2-(2,4-dibromophenoxy)-1,3-oxazole (CID 68870605) is 2-(2,4-dibromophenoxy)-1,3-oxazole.
What is the SMILES notation for 2-(2,4-dibromophenoxy)-1,3-oxazole?
The canonical SMILES for 2-(2,4-dibromophenoxy)-1,3-oxazole is Brc1ccc(Oc2ncco2)c(Br)c1.
What is the InChIKey of 2-(2,4-dibromophenoxy)-1,3-oxazole?
The InChIKey is CPJXZIOKKXRKEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5Br2NO2/c10-6-1-2-8(7(11)5-6)14-9-12-3-4-13-9/h1-5H.
What are the key properties of 2-(2,4-dibromophenoxy)-1,3-oxazole?
2-(2,4-dibromophenoxy)-1,3-oxazole has a molecular weight of 318.95 g/mol, XLogP of 3.99, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dibromophenoxy)-1,3-oxazole is sourced from PubChem (CID 68870605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).