6-Bromo-2-cyclopropyl-7-fluoro-5-methylbenzoxazole-4-carbonitrile

HCID 51041427

Basic information

Standard SMILES
Cc1c(Br)c(F)c2oc(C3CC3)nc2c1C#N
InChIKey
VOWZHBQDXGPRFC-UHFFFAOYSA-N
Molecular formula
C12H8BrFN2O
Average molar mass
295.11 g/mol

Names & identifiers

Preferred name
6-Bromo-2-cyclopropyl-7-fluoro-5-methylbenzoxazole-4-carbonitrile
IUPAC
6-bromo-2-cyclopropyl-7-fluoro-5-methyl-1,3-benzoxazole-4-carbonitrile

Names & synonyms

SCHEMBL3292443VOWZHBQDXGPRFC-UHFFFAOYSA-N6-Bromo-2-cyclopropyl-7-fluoro-5-methylbenzoxazole-4-carbonitrile6-bromo-2-cyclopropyl-7-fluoro-5-methyl-1,3-benzoxazole-4-carbonitrile

Database identifiers

PubChem CID
51041427

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
49.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
17

Related reactions

29 records

Linked notes

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