Chem
J-GLOBAL ID:200907027975381302   Nikkaji number:J1.688.077I

3β-Azido-3-[(S)-1-hydroxypropyl]-6-chloro-2,3-dihydro-4H-1-benzopyran-4-one

3β-アジド-3-[(S)-1-ヒドロキシプロピル]-6-クロロ-2,3-ジヒドロ-4H-1-ベンゾピラン-4-オン
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C12H12ClN[N-][N+]O3
Molecular formula furigana: C12-H12-CL-N3-O3
Molecular weight: 281.700
InChI: InChI=1S/C12H12ClN3O3/c1-2-10(17)12(15-16-14)6-19-9-4-3-7(13)5-8(9)11(12)18/h3-5,10,17H,2,6H2,1H3/t10-,12-/m0/s1
InChI key: JEACUOOOIVPFNO-JQWIXIFHSA-N
SMILES: CC[C@H](O)[C@]1(COc2ccc(Cl)cc2C1=O)N=[N+]=[N-]
Systematic name  (3):
  • 3β-アジド-3-[(S)-1-ヒドロキシプロピル]-6-クロロ-2,3-ジヒドロ-4H-1-ベンゾピラン-4-オン
  • (3S)-3-アジド-6-クロロ-3-[(1S)-1-ヒドロキシプロピル]-3,4-ジヒドロ-2H-1-ベンゾピラン-4-オン
  • (3S)-3-azido-6-chloro-3-[(1S)-1-hydroxypropyl]-3,4-dihydro-2H-1-benzopyran-4-one
Other name (1):
  • 3β-Azido-3-[(S)-1-hydroxypropyl]-6-chloro-2,3-dihydro-4H-1-benzopyran-4-one
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