159686-24-5
中文名稱
1-Butanone, 1-(3-ethyl-2,4-dihydroxy-6-methoxyphenyl)-
英文名稱
1-Butanone, 1-(3-ethyl-2,4-dihydroxy-6-methoxyphenyl)-
CAS
159686-24-5
分子式
C13H18O4
分子量
238.28
MOL 文件
159686-24-5.mol
159686-24-5 結(jié)構(gòu)式
基本信息
英文別名
1-Butanone, 1-(3-ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-?(3-?Ethyl-?2,?4-?dihydroxy-?6-?methoxyphenyl)?-1-butanone
1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone >=95% (LC/MS-UV)
物理化學(xué)性質(zhì)
沸點(diǎn)390.3±22.0 °C(Predicted)
密度1.147±0.06 g/cm3(Predicted)
儲(chǔ)存條件-20°C
溶解度DMSO: 1mg/mL
酸度系數(shù)(pKa)7.58±0.45(Predicted)
形態(tài)solid
主要應(yīng)用metabolomics
vitamins, nutraceuticals, and natural products
vitamins, nutraceuticals, and natural products
InChI1S/C13H18O4/c1-4-6-9(14)12-11(17-3)7-10(15)8(5-2)13(12)16/h7,15-16H,4-6H2,1-3H3
InChIKeyGRQAKVFPDMDUIF-UHFFFAOYSA-N
SMILESOC1=C(C(O)=CC(OC)=C1C(CCC)=O)CC