Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 5-Heptyn-2-one, 7-(dimethylamino)-, oxalate (1:1)
RN: 3921-91-3
InChIKey: GIIPHABZOPWETH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H15-N-O.C2-H2-O4

Molecular Weight

  • 243.257
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • 7-Dimethylaminohept-5-yn-2-one hydrogen oxalate

Systematic Name

  • 5-Heptyn-2-one, 7-(dimethylamino)-, oxalate (1:1)

Registry Numbers

CAS Registry Number

  • 3921-91-3

System Generated Number

  • 0003921913

Molecular Formulas

Molecular Formula

  • C9-H15-N-O.C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C9-H15-N-O
  • COMPONENT

Structure Descriptors

InChI

1S/C9H15NO.C2H2O4/c1-9(11)7-5-4-6-8-10(2)3;3-1(4)2(5)6/h5,7-8H2,1-3H3;(H,3,4)(H,5,6)

InChIKey

GIIPHABZOPWETH-UHFFFAOYSA-N

Smiles

C(C([O-])=O)(O)=O.C(CCC#CC[NH+](C)C)(C)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 50mg/kg (50mg/kg)   British Journal of Pharmacology and Chemotherapy. Vol. 26, Pg. 56, 1966.