3-Benzyl-6-methoxy-2,4-dihydro-1,3-benzoxazine

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Basic information

CAS: 52055-70-6
Standard SMILES: COc1ccc2c(c1)CN(Cc1ccccc1)CO2
InChIKey: MBFLBYFWELADSX-UHFFFAOYSA-N
Molecular formula: C16H17NO2
Average molar mass: 255.31 g/mol
Monoisotopic mass: 255.12592879

Names & identifiers

Preferred name: 3-Benzyl-6-methoxy-2,4-dihydro-1,3-benzoxazine
IUPAC: 3-benzyl-6-methoxy-2,4-dihydro-1,3-benzoxazine

Names & synonyms

3-benzyl-6-methoxy-2,4-dihydro-1,3-benzoxazine52055-70-6DTXSID40320759RefChem:277043DTXCID102718803-benzyl-6-methoxy-3,4-dihydro-2H-1,3-benzoxazineNSC364012ChemDiv2_005031HMS1383E15STL262822AKOS001684783CCG-118500

Show more names

NSC-364012IDI1_003746SR-01000115196SR-01000115196-13-benzyl-6-methoxy-3,4-dihydro-2H-benzo[e][1,3]oxazine

Database identifiers

CAS: 52055-70-6
PubChem CID: 339076
DTXSID: DTXSID40320759

Properties

Computed structural properties

XLogP: 3.1
Topological polar surface area: 21.7 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 19
Formal charge: 0
Complexity: 278

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Compound notes

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