p-CYMENE-2-CARBOXYLIC ACID, 3-HYDROXY-, METHYL ESTER

CAS 6547-90-6 MFCD N/A

化学结构图

6547-90-6
SMILES: COC(=O)c1c(C)ccc(C(C)C)c1O

化学属性

Mol. FormulaC12H16O3
Mol. Weight208.28

别名和识别编码

Wiswesser Line Notation1Y1&R BQ D1 CVO1
Chemical Namep-Cymene-2-carboxylic acid, 3-hydroxy-, methyl ester
Synonym Methyl 2-hydroxy-3-isopropyl-6-methylbenzoate 3-Hydroxy-p-cymene-2-carboxylic acid methyl ester
CAS Number6547-90-6
Beilstein Registry Number2580525
InChIKeyKGKUFUAVDRILEF-UHFFFAOYSA-N
PubChem Substance ID23043
InChIInChI=1S/C12H16O3/c1-7(2)9-6-5-8(3)10(11(9)13)12(14)15-4/h5-7,13H,1-4H3
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安全信息

RTECSGZ6021000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 420 mg/kg
TOXIC EFFECTS :
   Behavioral - altered sleep time (including change in righting reflex)
   Behavioral - changes in motor activity (specific assay)
REFERENCE :
   JMPCAS Journal of Medicinal and Pharmaceutical Chemistry.  (Washington, DC)
   V.1-5, 1959-62.  For publisher information, see JMCMAR.
   Volume(issue)/page/year: 2,213,1960

系列性分类

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