Methyl 2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxylate
概要:Methyl 2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxylate(CAS 102437-87-6)是一种化学化合物,分子式为C7H10O3S,分子量为174.04 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。
methyl 6-methyl-2,3-dihydro-1,4-oxathiine-5-carboxylate
又称:Methyl 2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxylate, J1.319.687G, 2-Methyl-3-methoxycarbonyl-4,5-dihydro-1,4-oxathiine, methyl 6-methyl-2,3-dihydro-1,4-oxathiine-5-carboxylate, Methyl 2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxylate #
| 分子式 | C7H10O3S |
|---|---|
| 分子量 | 174.04 g/mol |
| LogP | 0.4 |
| 拓扑极性表面积 | 60.8 Ų |
| 氢键供体数 | 0 |
| 氢键受体数 | 4 |
| 可旋转键数 | 2 |
| 精确质量 | 174.03506 |
| 重原子数 | 11 |
| 复杂度 | 198.0 |
化学标识符
| CAS 编号 | 102437-87-6 |
|---|---|
| SMILES | CC1=C(SCCO1)C(=O)OC |
| InChIKey | WBXUJOBNOPPTTM-UHFFFAOYSA-N |
产品概述
Methyl 2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxylate(CAS 102437-87-6),分子式为C7H10O3S,分子量为174.04 g/mol。IUPAC名:methyl 6-methyl-2,3-dihydro-1,4-oxathiine-5-carboxylate。
Methyl 2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxylate化学性质概览
属性洞察:Methyl 2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxylate
Methyl 2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxylate的XLogP值为0.4,表明具有中等亲脂性,在水溶性和膜透过性之间取得平衡。 TPSA为60.8 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,Methyl 2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxylate有0个氢键供体和4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
Methyl 2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxylate的CAS号是多少?
Methyl 2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxylate的CAS号为102437-87-6。
Methyl 2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxylate的分子式是什么?
Methyl 2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxylate的分子式为C7H10O3S。
Methyl 2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxylate的分子量是多少?
Methyl 2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxylate的分子量为174.04 g/mol。
在哪里可以购买Methyl 2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxylate?
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