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Substance Name: Cyclopropanecarboxylic acid, 3-(2-carboxy-1-propenyl)-2,2-dimethyl-, (1-alpha,3-beta(E))-(+)-
RN: 33383-55-0
InChIKey: XXTFGUFRXPWYDA-LYNIJRAASA-N

Molecular Formula

  • C10-H14-O4

Molecular Weight

  • 198.217
 
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Names and Synonyms

Synonym

  • (+)-(1-alpha,3-beta(E))-3-(2-Carboxy-1-propenyl)-2,2-dimethylcyclopropanecarboxylic acid

Systematic Name

  • Cyclopropanecarboxylic acid, 3-(2-carboxy-1-propenyl)-2,2-dimethyl-, (1-alpha,3-beta(E))-(+)-

Registry Numbers

CAS Registry Number

  • 33383-55-0

System Generated Number

  • 0033383550

Structure Descriptors

InChI

1S/C10H14O4/c1-5(8(11)12)4-6-7(9(13)14)10(6,2)3/h4,6-7H,1-3H3,(H,11,12)(H,13,14)/b5-4+/t6-,7+/m0/s1

InChIKey

XXTFGUFRXPWYDA-LYNIJRAASA-N

Smiles

C1([C@H]([C@@H]1C(O)=O)\C=C(\C(O)=O)C)(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 408mg/kg (408mg/kg)   Journal of Agricultural and Food Chemistry. Vol. 23, Pg. 106, 1975.