(E)-3,7-Dimethylocta-2,6-dien-1-yl benzoate (E)-3,7-二甲基辛基-2,6-二烯-1-基苯甲酸酯

CAS 94-48-4 MFCD00036513

化学结构图

94-48-4
SMILES: CC(C)=CCC/C(C)=C/COC(=O)c1ccccc1

化学属性

Mol. FormulaC17H22O2
Mol. Weight258.36
Refractive indexn20/D 1.517(lit.)
Density0.996 g/mL at 25 °C(lit.)
Boiling Point305 °C at 760 mmHg

别名和识别编码

Chemical Name(E)-3,7-Dimethylocta-2,6-dien-1-yl benzoate
MDL NumberMFCD00036513
CAS Number94-48-4
PubChem Substance ID5353011
EC Number202-337-0
Synonym (E)-3,7-dimethylocta-2,6-dien-1-yl benzoate {LY} (E)-3,7-dimethylocta-2,6-dien-1-yl benzoate {} {LY} (E)-3,7-dimethylocta-2,6-dien-1-yl benzoate {} {} {LY} (E)-3,7-dimethylocta-2,6-dien-1-yl benzoate {} {} {} {LY} (E)-3,7-dimethylocta-2,6-dien-1-yl benzoate {} {} {} {} {LY} (E)-3,7-dimethylocta-2,6-dien-1-yl benzoate {} {} {} {} {} {LY} (E)-3,7-dimethylocta-2,6-dien-1-yl benzoate {} {} {} {} {} {} {} {} {} {} {} {} {LY} (E)-3,7-dimethylocta-2,6-dien-1-yl benzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} (E)-3,7-dimethylocta-2,6-dien-1-yl benzoate {} {} {} {} {} {} {} {} {LY} (E)-3,7-dimethylocta-2,6-dien-1-yl benzoate {} {} {} {} {} {} {} {} {} {LY} (E)-3,7-dimethylocta-2,6-dien-1-yl benzoate {} {} {} {} {} {} {} {} {} {} {LY} (E)-3,7-dimethylocta-2,6-dien-1-yl benzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} (E)-3,7-dimethylocta-2,6-dien-1-yl benzoate {} {} {} {} {} {} {} {} {} {} {} {} {LY} (E)-3,7-dimethylocta-2,6-dien-1-yl
Beilstein Registry Number3119464
Chemical Name Translation(E)-3,7-二甲基辛基-2,6-二烯-1-基苯甲酸酯
InChIInChI=1S/C17H22O2/c1-14(2)8-7-9-15(3)12-13-19-17(18)16-10-5-4-6-11-16/h4-6,8,10-12H,7,9,13H2,1-3H3/b15-12+
LabNetwork Molecule IDLN04650537
Canonical SMILESCC(=CCC/C(=C/COC(=O)C1=CC=CC=C1)/C)C
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安全信息

WGK Germany2
RTECSRG5925300
Personal Protective Equipment Eyeshields, Gloves 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : >5 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FCTXAV Food and Cosmetics Toxicology.  (London, UK)  V.1-19, 1963-81.  For
   publisher information, see FCTOD7.  Volume(issue)/page/year: 12,887,1974

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : >5 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FCTXAV Food and Cosmetics Toxicology.  (London, UK)  V.1-19, 1963-81.  For
   publisher information, see FCTOD7.  Volume(issue)/page/year: 12,887,1974

Storage condition

系列性分类

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