CAS号:70293-55-9-4-甲基丙烯酰氧基偏苯三酸酐 - 2-(Methacryloyloxy)ethyl 1,3-dioxo-1,3-dihydroisobenzofuran-5-carboxylate-科华智慧

1. 主信息

英文名:	2-(Methacryloyloxy)ethyl 1,3-dioxo-1,3-dihydroisobenzofuran-5-carboxylate
中文名:	4-甲基丙烯酰氧基偏苯三酸酐
CAS编号:	70293-55-9
化学分子式：	C₁₅H₁₂O₇
化学分子量：	304.25 g/mol
SMILES：	CC(=C)C(=O)OCCOC(=O)C1=CC2=C(C=C1)C(=O)OC2=O
来源：	合成化合物
结构类型：	-
其它名称或标识：	4-META 4-methacryloxyethyltrimellitate anhydride 4-methacryloxyethyltrimellitic acid anhydride Cover-Up II

2. 供应商与价格

供应商	包装规格	含量	价格(元)	环境要求	货期	说明
科华智慧	1g	98%(stabilizedwithBHT)	608	2-8℃	现货	-
科华智慧	5g	98%(stabilizedwithBHT)	1840	2-8℃	现货	-

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3. 结构

3.1 二维结构

3.2 三维结构

-1 -2 -3 34 35 0 0 0 0 0 0 0999 V2000 3.8322 2.2598 -0.1779 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0123 -1.7184 -0.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4717 -0.3857 0.0132 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6265 2.9246 0.0770 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7335 0.9508 -0.3849 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0947 -3.4431 0.8734 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1848 0.2771 -1.3740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3115 0.6382 0.0289 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5409 0.0473 -0.1095 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2835 -1.4944 0.1849 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1558 -0.1029 0.1789 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6981 -1.3247 -0.1075 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5460 -2.1013 0.0427 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4863 2.0727 -0.0138 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5356 1.0876 -0.2446 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1001 -2.3256 0.3406 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2454 -2.4396 -0.0803 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3528 -1.6101 -0.7011 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4337 0.4753 -0.4295 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4385 1.7057 0.4099 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4737 1.8493 1.5469 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3317 2.6575 0.1017 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1991 0.3945 0.2977 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6711 -1.7893 -0.2178 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6409 -3.1847 0.0449 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1519 -3.3957 -0.6065 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4628 -2.6183 0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2996 -2.1594 -0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1052 -1.3860 -1.7452 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6239 1.0514 2.2815 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4417 1.8022 1.1835 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5954 2.8045 2.0689 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3847 3.5773 0.6759 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0326 2.5590 -0.7205 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 16 1 0 0 0 0 2 17 1 0 0 0 0 3 18 1 0 0 0 0 3 19 1 0 0 0 0 4 14 2 0 0 0 0 5 15 2 0 0 0 0 6 16 2 0 0 0 0 7 19 2 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 8 14 1 0 0 0 0 9 12 1 0 0 0 0 9 15 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 10 16 1 0 0 0 0 11 23 1 0 0 0 0 12 13 2 0 0 0 0 12 24 1 0 0 0 0 13 25 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 18 28 1 0 0 0 0 18 29 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 2 0 0 0 0 21 30 1 0 0 0 0 21 31 1 0 0 0 0 21 32 1 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0

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4. 国际命名与标识

4.1 IUPAC Name

2-(2-methylprop-2-enoyloxy)ethyl 1,3-dioxo-2-benzofuran-5-carboxylate

4.2 InChl

InChI=1S/C15H12O7/c1-8(2)12(16)20-5-6-21-13(17)9-3-4-10-11(7-9)15(19)22-14(10)18/h3-4,7H,1,5-6H2,2H3

4.3 InChlKey

RMCCONIRBZIDTH-UHFFFAOYSA-N

4.4 Canonical SMILES

CC(=C)C(=O)OCCOC(=O)C1=CC2=C(C=C1)C(=O)OC2=O

4.5 lsomeric SMILES

4.6 SDF文件

补充中

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5. 波谱数据

5.1 ¹³C核磁共振谱(¹³C NMR)

5.2 ¹H核磁共振谱(¹H NMR)

5.3 质谱(MS)

补充中

5.4 红外光谱(IR)

补充中

5.5 紫外/可见光谱(UV/Vis)

补充中

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6. 相关药材

中文名称

英文名称

拉丁文名称

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7. 相关靶点

基因靶点

靶点位置

参考文献

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8. 相关疾病

疾病名称

疾病类型