CAS号:29232-93-7-- - Pirimiphos-methyl-科华智慧

1. 主信息

英文名:	Pirimiphos-methyl
中文名:	-
CAS编号:	29232-93-7
化学分子式：	C₁₁H₂₀N₃O₃PS
化学分子量：	305.34 g/mol
SMILES：	CCN(CC)C1=NC(=CC(=N1)OP(=S)(OC)OC)C
来源：	合成化合物
结构类型：	-
其它名称或标识：	Actellic Aktel O-(2-(diethylamino)-6-methyl-4-pyrimidinyl) O,O- dimethylphosphorothioate lic pirimiphos methyl pirimiphosmethyl

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	1.2ml	100μg/ml in acetone	80	2-8℃	现货	-
科华智慧	1.2ml	1000μg/ml in acetone	208	2-8℃	现货	-
科华智慧	1.2ml	1000μg/ml in methanol	208	2-8℃	现货	-
科华智慧	100mg	97.5%	544	2-8℃	现货	-
科华智慧	1.2ml	100μg/ml in acetone	64	-20℃；避光	现货	-
科华智慧	1.2ml	1000μg/ml in acetone	166	-20℃；避光	现货	-
科华智慧	1.2ml	100μg/ml in methanol	64	-20℃；避光	现货	-
科华智慧	1.2ml	1000μg/ml in methanol	166	-20℃；避光	现货	-

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3. 结构

3.1 二维结构

3.2 三维结构

-1 -2 -3 39 39 0 0 0 0 0 0 0999 V2000 2.4950 1.1468 2.0262 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6887 0.2464 0.3070 P 0 0 0 0 0 0 0 0 0 0 0 0 1.7947 -1.0852 0.0699 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2926 1.1260 -1.0051 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1773 -0.2666 -0.1032 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3186 1.1167 0.0704 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2912 -1.2098 -0.2333 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2429 0.0226 0.0721 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7634 1.0997 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6398 2.3761 0.2976 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5812 -0.0826 -0.0354 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3825 0.8864 1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2632 3.0127 -1.0264 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5554 -2.3367 -0.3294 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4309 -1.1420 -0.0334 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -2.3638 -0.2361 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3026 -3.6093 -0.5478 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8703 2.4065 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7702 -1.3438 0.6021 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1188 2.0586 -0.4308 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1217 0.3426 -0.7406 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3017 3.0640 0.8386 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7563 2.2636 0.9364 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0861 -0.0768 1.7629 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0786 1.6703 2.0367 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4746 0.9020 1.2631 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5748 2.3785 -1.5945 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1465 3.1875 -1.6496 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7719 3.9760 -0.8574 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3901 -3.2816 -0.3162 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1174 -4.3058 0.2761 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3812 -3.4279 -0.6003 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9928 -4.0763 -1.4881 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7390 2.6941 -2.2431 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9388 2.3845 -0.9667 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3639 3.1391 -0.5638 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8793 -1.0887 1.6589 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7597 -1.5349 0.1795 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1600 -2.2443 0.4966 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 15 1 0 0 0 0 4 18 1 0 0 0 0 5 19 1 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 7 11 2 0 0 0 0 7 14 1 0 0 0 0 8 11 1 0 0 0 0 8 15 2 0 0 0 0 9 12 1 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 10 13 1 0 0 0 0 10 22 1 0 0 0 0 10 23 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 16 30 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0

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4. 国际命名与标识

4.1 IUPAC Name

4-dimethoxyphosphinothioyloxy-N,N-diethyl-6-methylpyrimidin-2-amine

4.2 InChl

InChI=1S/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3

4.3 InChlKey

QHOQHJPRIBSPCY-UHFFFAOYSA-N

4.4 Canonical SMILES

CCN(CC)C1=NC(=CC(=N1)OP(=S)(OC)OC)C

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