Methyl 3,3-dimethyl-4-nitrobutanoate

CAS Registry Number®

34687-04-2
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CAS Name

Methyl 3,3-dimethyl-4-nitrobutanoate

Molecular Formula

C7H13NO4

Molecular Mass

175.18

Cite this Page

Methyl 3,3-dimethyl-4-nitrobutanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=34687-04-2 (retrieved 2024-07-30) (CAS RN: 34687-04-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    70-75 °C @ Press: 0.5 Torr

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C7H13NO4/c1-7(2,5-8(10)11)4-6(9)12-3/h4-5H2,1-3H3

InChIKey

InChIKey=MROKADHZDXBQMO-UHFFFAOYSA-N

SMILES

C(CC(OC)=O)(CN(=O)=O)(C)C

Canonical SMILES

O=C(OC)CC(C)(C)CN(=O)=O

Other Names for this Substance

  • Butanoic acid, 3,3-dimethyl-4-nitro-, methyl ester
  • Methyl 3,3-dimethyl-4-nitrobutanoate
  • Methyl 3,3-dimethyl-4-nitrobutyrate