Methyl 2,6-dichlorobenzoxazole-4-carboxylate
Basic information
- Standard SMILES
COC(=O)c1cc(Cl)cc2oc(Cl)nc12- InChIKey
QDQDTXIDJFYLQR-UHFFFAOYSA-N- Molecular formula
- C9H5Cl2NO3
- Average molar mass
- 246.04 g/mol
- Monoisotopic mass
- 244.9646484
Names & identifiers
- Preferred name
- Methyl 2,6-dichlorobenzoxazole-4-carboxylate
- IUPAC
- methyl 2,6-dichloro-1,3-benzoxazole-4-carboxylate
Names & synonyms
SCHEMBL1005229QDQDTXIDJFYLQR-UHFFFAOYSA-Nmethyl 2,6-dichlorobenzoxazole-4-carboxylate
Database identifiers
- PubChem CID
- 58085877
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 264
Related reactions
4 records
Compound notes
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