Ethyl 3,4-dihydro-4-phenyl-2H-1,4-benzoxazine-2-carboxylate

HCID 86614014
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Basic information

CAS
281658-45-5
Standard SMILES
CCOC(=O)C1CN(c2ccccc2)c2ccccc2O1
InChIKey
LFQRQIXOQWPUJE-UHFFFAOYSA-N
Molecular formula
C17H17NO3
Average molar mass
283.32 g/mol
Monoisotopic mass
283.1208434

Names & identifiers

Preferred name
Ethyl 3,4-dihydro-4-phenyl-2H-1,4-benzoxazine-2-carboxylate
IUPAC
ethyl 4-phenyl-2,3-dihydro-1,4-benzoxazine-2-carboxylate

Names & synonyms

LFQRQIXOQWPUJE-UHFFFAOYSA-NDTXSID801190761281658-45-5Ethyl 3,4-dihydro-4-phenyl-2H-1,4-benzoxazine-2-carboxylateEthyl 4-phenyl-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate(+/-)-Ethyl 4-phenyl-3,4-dihydro-2H-benzo[b][1,4]oxazine-2-carboxylate

Database identifiers

CAS
281658-45-5
PubChem CID
86614014
DTXSID
DTXSID801190761

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
38.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
21

Related reactions

3 records
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Compound notes

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