(E)-4-hydroxy-4-oxobut-2-enoate;pyridin-1-ium-3-ylmethyl pyridine-3-carboxylate
概要：(E)-4-hydroxy-4-oxobut-2-enoate;pyridin-1-ium-3-ylmethyl pyridine-3-carboxylate（CAS 63861-52-9）是一种化学化合物，分子式为C16H14N2O6，分子量为330.09 g/mol。河南科弘生物科技有限公司提供CRO/CDMO定制合成服务，支持克级到吨级规格。
(E)-4-hydroxy-4-oxobut-2-enoate;pyridin-1-ium-3-ylmethyl pyridine-3-carboxylate
又称：3-Pyridylmethyl nicotinate monofumarate, NICOTINIC ACID, 3-PYRIDYLMETHYL ESTER, FUMARATE, Cyclopentanecarboxylic acid,2,2-dimethyl-,methyl ester, (E)-4-hydroxy-4-oxobut-2-enoate; pyridin-1-ium-3-ylmethyl pyridine-3-carboxylate, Nicotinic acid pyridin-3-ylmethyl ester; compound with (E)-but-2-enedioic acid
| 分子式 | C16H14N2O6 |
|---|---|
| 分子量 | 330.09 g/mol |
| LogP | -0.3702 |
| 拓扑极性表面积 | 130.76 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 6 |
| 可旋转键数 | 5 |
| 精确质量 | 330.08517 |
| 重原子数 | 24 |
| 复杂度 | 685.0223 |
化学标识符
| CAS 编号 | 63861-52-9 |
|---|---|
| SMILES | C1=CC(=C[NH+]=C1)COC(=O)C2=CN=CC=C2.C(=C/C(=O)[O-])\C(=O)O |
产品概述
(E)-4-hydroxy-4-oxobut-2-enoate;pyridin-1-ium-3-ylmethyl pyridine-3-carboxylate（CAS 63861-52-9），分子式为C16H14N2O6，分子量为330.09 g/mol。IUPAC名：(E)-4-hydroxy-4-oxobut-2-enoate;pyridin-1-ium-3-ylmethyl pyridine-3-carboxylate。
(E)-4-hydroxy-4-oxobut-2-enoate;pyridin-1-ium-3-ylmethyl pyridine-3-carboxylate化学性质概览
属性洞察：(E)-4-hydroxy-4-oxobut-2-enoate;pyridin-1-ium-3-ylmethyl pyridine-3-carboxylate
(E)-4-hydroxy-4-oxobut-2-enoate;pyridin-1-ium-3-ylmethyl pyridine-3-carboxylate的XLogP值为-0.3702，表明该化合物具有亲水性（水溶性好），适合水性配方和生物检测应用。 TPSA为130.76 Ų，处于中等极性范围，在透过性和溶解性之间取得平衡。 根据Lipinski五规则，(E)-4-hydroxy-4-oxobut-2-enoate;pyridin-1-ium-3-ylmethyl pyridine-3-carboxylate有1个氢键供体和6个氢键受体，均在类药范围内，提示具有较好的口服生物利用度潜力。
常见问题
常见问题
(E)-4-hydroxy-4-oxobut-2-enoate;pyridin-1-ium-3-ylmethyl pyridine-3-carboxylate的CAS号是多少？
(E)-4-hydroxy-4-oxobut-2-enoate;pyridin-1-ium-3-ylmethyl pyridine-3-carboxylate的CAS号为63861-52-9。
(E)-4-hydroxy-4-oxobut-2-enoate;pyridin-1-ium-3-ylmethyl pyridine-3-carboxylate的分子式是什么？
(E)-4-hydroxy-4-oxobut-2-enoate;pyridin-1-ium-3-ylmethyl pyridine-3-carboxylate的分子式为C16H14N2O6。
(E)-4-hydroxy-4-oxobut-2-enoate;pyridin-1-ium-3-ylmethyl pyridine-3-carboxylate的分子量是多少？
(E)-4-hydroxy-4-oxobut-2-enoate;pyridin-1-ium-3-ylmethyl pyridine-3-carboxylate的分子量为330.09 g/mol。
在哪里可以购买(E)-4-hydroxy-4-oxobut-2-enoate;pyridin-1-ium-3-ylmethyl pyridine-3-carboxylate？
您可以直接向科弘生物询价(E)-4-hydroxy-4-oxobut-2-enoate;pyridin-1-ium-3-ylmethyl pyridine-3-carboxylate。联系我们或发送邮件至info@kehongbio.com获取报价和库存信息。
科弘生物是否提供(E)-4-hydroxy-4-oxobut-2-enoate;pyridin-1-ium-3-ylmethyl pyridine-3-carboxylate的定制合成服务？
是的，科弘生物提供(E)-4-hydroxy-4-oxobut-2-enoate;pyridin-1-ium-3-ylmethyl pyridine-3-carboxylate及相关化合物的定制合成服务。请联系我们并告知您的具体需求，包括数量、纯度和交期。