CAS号:376-06-7-全氟十四酸 - Perfluorotetradecanoic acid-科华智慧

1. 主信息

英文名:	Perfluorotetradecanoic acid
中文名:	全氟十四酸
CAS编号:	376-06-7
化学分子式：	C₁₃F₂₇COOH
化学分子量：	714.11 g/mol
SMILES：	C(=O)(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O
来源：	合成化合物
结构类型：	-
其它名称或标识：	2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-heptacosafluorotetradecanoate 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-heptacosafluorotetradecanoic acid heptacosafluorotetradecanoate heptacosafluorotetradecanoic acid methyl 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-heptacosafluorotetradecanoate

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	100mg	Purity≥96%	467	2-8℃	现货	-
科华智慧	1g	95%	240	2-8℃	现货	-

回顶

3. 结构

3.1 二维结构

3.2 三维结构

-1 -2 -3 44 43 0 0 0 0 0 0 0999 V2000 -1.0853 1.6620 -1.0740 F 0 0 0 0 0 0 0 0 0 0 0 0 0.3352 0.2373 -1.9027 F 0 0 0 0 0 0 0 0 0 0 0 0 1.3957 1.9491 -0.0729 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.0509 1.3275 1.4253 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.5709 -1.7463 -0.4054 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.0691 -0.7557 -1.6351 F 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -1.2297 1.2623 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3569 0.2665 1.7823 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.4794 -0.3664 1.8095 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.9507 -1.6346 0.8336 F 0 0 0 0 0 0 0 0 0 0 0 0 3.2690 -1.7906 0.2907 F 0 0 0 0 0 0 0 0 0 0 0 0 1.8162 -1.3693 -1.2613 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.8894 0.6876 1.8444 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.4675 1.8391 0.6804 F 0 0 0 0 0 0 0 0 0 0 0 0 4.2543 -0.5398 -1.9178 F 0 0 0 0 0 0 0 0 0 0 0 0 2.8392 1.0845 -1.6429 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.5188 0.9785 -1.6392 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.9006 1.9667 -0.2895 F 0 0 0 0 0 0 0 0 0 0 0 0 3.8729 1.6534 0.8157 F 0 0 0 0 0 0 0 0 0 0 0 0 5.3275 1.7077 -0.8014 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.9748 0.0241 -1.7689 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.5716 -1.4585 -1.0280 F 0 0 0 0 0 0 0 0 0 0 0 0 4.7004 -0.7379 1.6480 F 0 0 0 0 0 0 0 0 0 0 0 0 6.2617 0.7689 1.5316 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.9052 0.4710 0.7781 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.9816 -1.6234 0.1695 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.4500 -0.9410 1.5635 F 0 0 0 0 0 0 0 0 0 0 0 0 7.5227 -0.3793 -0.3772 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9916 -2.0582 -0.4342 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3566 0.5551 -0.7733 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 0.8962 0.3346 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3065 -0.6096 -0.5127 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6065 -0.2023 0.7418 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2405 -0.4898 0.6843 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5689 -0.7748 -0.2887 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2050 0.6901 0.6661 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5701 0.1495 -0.9699 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2051 0.8061 -0.4751 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5586 0.8689 -0.0592 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2131 -0.3128 -0.6879 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4637 -0.0325 0.7693 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1510 -0.5996 0.4585 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3255 -0.9376 -0.0724 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0783 -0.9778 -0.9208 H 0 0 0 0 0 0 0 0 0 0 0 0 1 30 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 4 31 1 0 0 0 0 5 32 1 0 0 0 0 6 32 1 0 0 0 0 7 33 1 0 0 0 0 8 33 1 0 0 0 0 9 34 1 0 0 0 0 10 34 1 0 0 0 0 11 35 1 0 0 0 0 12 35 1 0 0 0 0 13 36 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 26 42 1 0 0 0 0 27 42 1 0 0 0 0 28 43 1 0 0 0 0 28 44 1 0 0 0 0 29 43 2 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 31 33 1 0 0 0 0 32 34 1 0 0 0 0 33 35 1 0 0 0 0 34 36 1 0 0 0 0 35 37 1 0 0 0 0 36 38 1 0 0 0 0 37 39 1 0 0 0 0 38 40 1 0 0 0 0 39 41 1 0 0 0 0 40 42 1 0 0 0 0 41 43 1 0 0 0 0

回顶

4. 国际命名与标识

4.1 IUPAC Name

2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-heptacosafluorotetradecanoic acid

4.2 InChl

InChI=1S/C14HF27O2/c15-2(16,1(42)43)3(17,18)4(19,20)5(21,22)6(23,24)7(25,26)8(27,28)9(29,30)10(31,32)11(33,34)12(35,36)13(37,38)14(39,40)41/h(H,42,43)

4.3 InChlKey

RUDINRUXCKIXAJ-UHFFFAOYSA-N

4.4 Canonical SMILES

C(=O)(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O

4.5 lsomeric SMILES

4.6 SDF文件

补充中

回顶

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

回顶

6. 相关药材

中文名称

英文名称

拉丁文名称

回顶

7. 相关靶点

基因靶点

靶点位置

参考文献

回顶

8. 相关疾病

疾病名称

疾病类型