3-Methylpent-1-yn-3-yl acetate

CAS 1185-96-2 MFCD N/A

化学结构图

1185-96-2
SMILES: C#CC(C)(CC)OC(C)=O

化学属性

Mol. Weight140.20
Mol. FormulaC8H12O2

别名和识别编码

Wiswesser Line Notation1VOX2&1&1UU1
Chemical Name1-Pentyn-3-ol, 3-methyl-, acetate
Synonym Acetic acid, 3-methyl-1-pentyn-3-yl ester 3-Methyl-pentin-1-acetat-(3)
CAS Number1185-96-2
InChIKeyDTLIDVRKEFPSGM-UHFFFAOYSA-N
PubChem Substance ID221250
InChIInChI=1S/C8H12O2/c1-5-8(4,6-2)10-7(3)9/h1H,6H2,2-4H3
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安全信息

RTECSSC4930000
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 900 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   ARZNAD Arzneimittel-Forschung. Drug Research.  (Editio Cantor Verlag,
   Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.)  V.1-    1951-
   Volume(issue)/page/year: 7,85,1957

系列性分类


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