Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Carbamic acid, (2-bromopropionyl)-, 2-methyl-2-propyltrimethylene ester
RN: 25648-71-9
InChIKey: ZHWPDMSUHBICJO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H24-Br2-N2-O6

Molecular Weight

  • 488.171
 
* 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

  • (2-Bromopropionyl)carbamic acid 2-methyl-2-propyltrimethylene ester

Systematic Name

  • Carbamic acid, (2-bromopropionyl)-, 2-methyl-2-propyltrimethylene ester

Registry Numbers

CAS Registry Number

  • 25648-71-9

System Generated Number

  • 0025648719

Structure Descriptors

InChI

1S/C15H24Br2N2O6/c1-7(2)11(25-15(23)19-13(21)10(5)17)8(3)6-24-14(22)18-12(20)9(4)16/h7-11H,6H2,1-5H3,(H,18,20,22)(H,19,21,23)

InChIKey

ZHWPDMSUHBICJO-UHFFFAOYSA-N

Smiles

C([C@@H]([C@@H](C(C)C)OC(NC(=O)[C@@H](C)Br)=O)C)OC(NC(=O)[C@@H](C)Br)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1400mg/kg (1400mg/kg) AUTONOMIC NERVOUS SYSTEM: "SMOOTH MUSCLE RELAXANT (MECHANISM UNDEFINED, SPASMOLYTIC)" Journal of Medicinal Chemistry. Vol. 12, Pg. 462, 1969.