Methyl 5-bromo-4-(1-methylethyl)-2-nitrobenzoate

CAS Registry Number®

1400645-04-6
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CAS Name

Methyl 5-bromo-4-(1-methylethyl)-2-nitrobenzoate

Molecular Formula

C11H12BrNO4

Molecular Mass

302.12

Cite this Page

Methyl 5-bromo-4-(1-methylethyl)-2-nitrobenzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1400645-04-6 (retrieved 2024-07-08) (CAS RN: 1400645-04-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H12BrNO4/c1-6(2)7-5-10(13(15)16)8(4-9(7)12)11(14)17-3/h4-6H,1-3H3

InChIKey

InChIKey=CJVOZHRQXALCMW-UHFFFAOYSA-N

SMILES

C(OC)(=O)C1=C(N(=O)=O)C=C(C(C)C)C(Br)=C1

Canonical SMILES

O=C(OC)C1=CC(Br)=C(C=C1N(=O)=O)C(C)C

Other Names for this Substance

  • Benzoic acid, 5-bromo-4-(1-methylethyl)-2-nitro-, methyl ester
  • Methyl 5-bromo-4-(1-methylethyl)-2-nitrobenzoate