1,1-Dimethylethyl 5-bromo-1,3-dihydro-6-nitro-2H-isoindole-2-carboxylate

CAS Registry Number®

1624261-08-0
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CAS Name

1,1-Dimethylethyl 5-bromo-1,3-dihydro-6-nitro-2H-isoindole-2-carboxylate

Molecular Formula

C13H15BrN2O4

Molecular Mass

343.17

Cite this Page

1,1-Dimethylethyl 5-bromo-1,3-dihydro-6-nitro-2H-isoindole-2-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1624261-08-0 (retrieved 2024-06-24) (CAS RN: 1624261-08-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H15BrN2O4/c1-13(2,3)20-12(17)15-6-8-4-10(14)11(16(18)19)5-9(8)7-15/h4-5H,6-7H2,1-3H3

InChIKey

InChIKey=XWPGGVJFQIZPPI-UHFFFAOYSA-N

SMILES

C(OC(C)(C)C)(=O)N1CC=2C(C1)=CC(Br)=C(N(=O)=O)C2

Canonical SMILES

O=C(OC(C)(C)C)N1CC2=CC(Br)=C(C=C2C1)N(=O)=O

Other Names for this Substance

  • 2H-Isoindole-2-carboxylic acid, 5-bromo-1,3-dihydro-6-nitro-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 5-bromo-1,3-dihydro-6-nitro-2H-isoindole-2-carboxylate

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