8-Ethoxy-2-methyl-3-oxo-3,4-dihydro-2H-benzo[b][1,4]oxazine-6-carbaldehyde

HCID 71813482
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Basic information

Standard SMILES
CCOc1cc(C=O)cc2c1OC(C)C(=O)N2
InChIKey
MYMBGDSQUPSQGQ-UHFFFAOYSA-N
Molecular formula
C12H13NO4
Average molar mass
235.24 g/mol
Monoisotopic mass
235.0844579

Names & identifiers

Preferred name
8-Ethoxy-2-methyl-3-oxo-3,4-dihydro-2H-benzo[b][1,4]oxazine-6-carbaldehyde
IUPAC
8-ethoxy-2-methyl-3-oxo-4H-1,4-benzoxazine-6-carbaldehyde

Names & synonyms

SCHEMBL532587MYMBGDSQUPSQGQ-UHFFFAOYSA-N8-Ethoxy-2-methyl-3-oxo-3,4-dihydro-2H-benzo[b][1,4]oxazine-6-carbaldehyde

Database identifiers

PubChem CID
71813482

Properties

Computed structural properties

XLogP
1.1
Topological polar surface area
64.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
17

Related reactions

6 records
New reaction record

Compound notes

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