1-Butanol, 3-methyl-, 1-(4-nitrobenzoate)

CAS Registry Number®

38120-06-8
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CAS Name

1-Butanol, 3-methyl-, 1-(4-nitrobenzoate)

Molecular Formula

C12H15NO4

Molecular Mass

237.25

Cite this Page

1-Butanol, 3-methyl-, 1-(4-nitrobenzoate).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=38120-06-8 (retrieved 2024-05-18) (CAS RN: 38120-06-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H15NO4/c1-9(2)7-8-17-12(14)10-3-5-11(6-4-10)13(15)16/h3-6,9H,7-8H2,1-2H3

InChIKey

InChIKey=KMOODDWVCAWHMC-UHFFFAOYSA-N

SMILES

C(OCCC(C)C)(=O)C1=CC=C(N(=O)=O)C=C1

Canonical SMILES

O=C(OCCC(C)C)C1=CC=C(C=C1)N(=O)=O

Other Names for this Substance

  • 1-Butanol, 3-methyl-, 1-(4-nitrobenzoate)
  • 1-Butanol, 3-methyl-, 4-nitrobenzoate
  • 3-Methyl-1-butyl p-nitrobenzoate
  • 3-Methylbutyl 4-nitrobenzoate
  • NSC 6031

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