2-(4-Bromo-3-methyl(phenyl))-benzoxazole

HCID 21990979
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Basic information

Standard SMILES
Cc1cc(-c2nc3ccccc3o2)ccc1Br
InChIKey
MJSIMDPANRSTQD-UHFFFAOYSA-N
Molecular formula
C14H10BrNO
Average molar mass
288.14 g/mol

Names & identifiers

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

Names & synonyms

SCHEMBL5832541MJSIMDPANRSTQD-UHFFFAOYSA-NAKOS0251230812-(4-bromo-3-methyl(phenyl))-benzoxazole2-(4-bromo-3-methylphenyl)-1,3-benzoxazole

Database identifiers

PubChem CID
21990979

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

3 records
New reaction record

Compound notes

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