2-(3-Bromo-4-methylphenyl)-1,3-benzoxazole

HCID 21990996
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1ccc(-c2nc3ccccc3o2)cc1Br
InChIKey
MBWCRARWJJHKSV-UHFFFAOYSA-N
Molecular formula
C14H10BrNO
Average molar mass
288.14 g/mol

Names & identifiers

Preferred name
2-(3-Bromo-4-methylphenyl)-1,3-benzoxazole
IUPAC
2-(3-bromo-4-methylphenyl)-1,3-benzoxazole

Names & synonyms

SCHEMBL5831975MBWCRARWJJHKSV-UHFFFAOYSA-NAKOS0329521282-(3-bromo-4-methylphenyl)-1,3-benzoxazole

Database identifiers

PubChem CID
21990996

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
26 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
17

Related reactions

5 records
New reaction record

Linked notes

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