1-[3-[(2-Ethylhexyl)amino]-1-methyl-3-oxopropyl] butanedioate

CAS Registry Number®

32838-28-1

CAS Name

1-[3-[(2-Ethylhexyl)amino]-1-methyl-3-oxopropyl] butanedioate

Molecular Formula

C16H29NO5

Molecular Mass

315.41

Cite this Page

1-[3-[(2-Ethylhexyl)amino]-1-methyl-3-oxopropyl] butanedioate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=32838-28-1 (retrieved 2024-11-23) (CAS RN: 32838-28-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    46.5 °C

Source(s)

  • (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

InChI

InChI=1S/C16H29NO5/c1-4-6-7-13(5-2)11-17-14(18)10-12(3)22-16(21)9-8-15(19)20/h12-13H,4-11H2,1-3H3,(H,17,18)(H,19,20)

InChIKey

InChIKey=CQONVBIGUJWUFE-UHFFFAOYSA-N

SMILES

C(CNC(CC(OC(CCC(O)=O)=O)C)=O)(CCCC)CC

Canonical SMILES

O=C(O)CCC(=O)OC(C)CC(=O)NCC(CC)CCCC

Other Names for this Substance

  • Butanedioic acid, 1-[3-[(2-ethylhexyl)amino]-1-methyl-3-oxopropyl] ester
  • Butanedioic acid, mono[3-[(2-ethylhexyl)amino]-1-methyl-3-oxopropyl] ester
  • Succinic acid, monoester with N-(2-ethylhexyl)-3-hydroxybutyramide
  • 1-[3-[(2-Ethylhexyl)amino]-1-methyl-3-oxopropyl] butanedioate
  • N-(2-Ethylhexyl)-3-hydroxybutyramide semisuccinate

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