186390-77-2

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186390-77-2 Structure

Identification	Back Directory
[Name] 6-NITRO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE
[CAS] 186390-77-2
[Synonyms] 6-NITRO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE 6-nitro-3,4-dihydro-1H-2l2-isoquinoline Isoquinoline,1,2,3,4-tetrahydro-6-nitro- 6-Nitro-1,2,3,4-tetrahydro-isoquinoline ,96%
[Molecular Formula] C9H10N2O2
[MDL Number] MFCD02684189
[MOL File] 186390-77-2.mol
[Molecular Weight] 178.19

Chemical Properties	Back Directory
[Boiling point ] 319.6±42.0 °C(Predicted)
[density ] 1.236±0.06 g/cm3(Predicted)
[storage temp. ] under inert gas (nitrogen or Argon) at 2–8 °C
[pka] 8.44±0.20(Predicted)
[InChI] InChI=1S/C9H10N2O2/c12-11(13)9-2-1-8-6-10-4-3-7(8)5-9/h1-2,5,10H,3-4,6H2
[InChIKey] OUZGPBWVRKFMLS-UHFFFAOYSA-N
[SMILES] C1C2=C(C=C([N+]([O-])=O)C=C2)CCN1

Hazard Information	Back Directory
[Synthesis Reference(s)] The Journal of Organic Chemistry, 63, p. 4116, 1998 DOI: 10.1021/jo972184e

Spectrum Detail	Back Directory
[Spectrum Detail] 6-NITRO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE(186390-77-2)¹HNMR

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