2-(2-bromophenyl)-5-(trifluoromethyl)-1,3-oxazole

C10H5BrF3NO — CID 141173140

IUPAC2-(2-bromophenyl)-5-(trifluoromethyl)-1,3-oxazole
SMILESFC(F)(F)c1cnc(-c2ccccc2Br)o1
InChIInChI=1S/C10H5BrF3NO/c11-7-4-2-1-3-6(7)9-15-5-8(16-9)10(12,13)14/h1-5H
InChIKeyAQPRSZWCROHPGL-UHFFFAOYSA-N
MW292.05 g/mol
LogP4.12
Rot. Bonds1

About 2-(2-bromophenyl)-5-(trifluoromethyl)-1,3-oxazole

2-(2-bromophenyl)-5-(trifluoromethyl)-1,3-oxazole (PubChem CID 141173140) has the molecular formula C10H5BrF3NO and a molecular weight of 292.05 g/mol. Its IUPAC name is 2-(2-bromophenyl)-5-(trifluoromethyl)-1,3-oxazole.

Molecular Properties

Compound Name2-(2-bromophenyl)-5-(trifluoromethyl)-1,3-oxazole
PubChem CID141173140
Molecular FormulaC10H5BrF3NO
Molecular Weight292.05 g/mol
Exact Mass290.95
IUPAC Name2-(2-bromophenyl)-5-(trifluoromethyl)-1,3-oxazole
SMILESFC(F)(F)c1cnc(-c2ccccc2Br)o1
InChIInChI=1S/C10H5BrF3NO/c11-7-4-2-1-3-6(7)9-15-5-8(16-9)10(12,13)14/h1-5H
InChIKeyAQPRSZWCROHPGL-UHFFFAOYSA-N
XLogP4.12
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.05
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-(2-bromophenyl)-1,3-oxazol-5-yl]ethanol
CID 115087224
5-chloro-2-[2-(trifluoromethyl)phenyl]-1,3-oxazole
CID 117258904
5-bromo-2-(2-fluorophenyl)-1,3-oxazole
CID 117258910
2-(2-bromophenyl)-5-tert-butyl-1,3,4-oxadiazole
CID 55028952
5-(2-bromophenyl)-N-[3-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-amine
CID 59152546
5-bromo-2-(2-methylphenyl)-1,3-oxazole
CID 73014198
3-(2-bromophenyl)-4,5-bis(trifluoromethyl)-1H-pyrazole
CID 173049957
5-(2-bromophenyl)oxadiazole
CID 86070760
2-(2-bromophenyl)-4-(chloromethyl)-5-methyl-1,3-oxazole
CID 53403506
1-[[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl]-3-(trifluoromethyl)pyridin-2-one
CID 39040407
N-[[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl]-1-(trifluoromethyl)cyclopropan-1-amine
CID 106212426
4-(2-bromophenyl)-2-(trifluoromethyl)-1,3-thiazole
CID 112700792

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenyl)-5-(trifluoromethyl)-1,3-oxazole?
The IUPAC name of 2-(2-bromophenyl)-5-(trifluoromethyl)-1,3-oxazole (CID 141173140) is 2-(2-bromophenyl)-5-(trifluoromethyl)-1,3-oxazole.
What is the SMILES notation for 2-(2-bromophenyl)-5-(trifluoromethyl)-1,3-oxazole?
The canonical SMILES for 2-(2-bromophenyl)-5-(trifluoromethyl)-1,3-oxazole is FC(F)(F)c1cnc(-c2ccccc2Br)o1.
What is the InChIKey of 2-(2-bromophenyl)-5-(trifluoromethyl)-1,3-oxazole?
The InChIKey is AQPRSZWCROHPGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5BrF3NO/c11-7-4-2-1-3-6(7)9-15-5-8(16-9)10(12,13)14/h1-5H.
What are the key properties of 2-(2-bromophenyl)-5-(trifluoromethyl)-1,3-oxazole?
2-(2-bromophenyl)-5-(trifluoromethyl)-1,3-oxazole has a molecular weight of 292.05 g/mol, XLogP of 4.12, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenyl)-5-(trifluoromethyl)-1,3-oxazole is sourced from PubChem (CID 141173140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).