Benzoic acid, 2-nitro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, methyl ester

CAS Registry Number®

1402238-34-9
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CAS Name

Benzoic acid, 2-nitro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, methyl ester

Molecular Formula

C14H18BNO6

Molecular Mass

307.11

Cite this Page

Benzoic acid, 2-nitro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1402238-34-9 (retrieved 2024-09-08) (CAS RN: 1402238-34-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H18BNO6/c1-13(2)14(3,4)22-15(21-13)9-6-7-10(12(17)20-5)11(8-9)16(18)19/h6-8H,1-5H3

InChIKey

InChIKey=YXJOPYXGQATVOC-UHFFFAOYSA-N

SMILES

CC1(C)OB(OC1(C)C)C2=CC(N(=O)=O)=C(C(OC)=O)C=C2

Canonical SMILES

O=C(OC)C1=CC=C(C=C1N(=O)=O)B2OC(C)(C)C(O2)(C)C

Other Names for this Substance

  • Benzoic acid, 2-nitro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, methyl ester
  • Methyl 2-nitro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate