compound introduction
抑制一氧化氮合酶；结构见第一个来源
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methyl carbamimidothioate
CAS number：2986-19-8 molecular formula：C2H6N2S
overview
Specs
| Chinese alias | - | ||
| English alias | Pseudourea,2-methyl-2-thio- (6CI,8CI); 2-Methyl-2-pseudothiourea; 2-Methyl-2-thiopseudourea; 2-Methylisothiourea; 2-Methylpseudothiourea; 2-Methylthiourea; Methylisothiourea; Methylisothiuronium; Methylthiopseudourea; S-Methylisothiourea; S-Methylpseudoth | ||
| CAS number | 2986-19-8 | molecular formula | C2H6N2S |
| molecular weight | 90.15 | Exact mass | - |
| PSA | 75.2 | logp | 0.2 |
numbering system
| CAS | 2986-19-8 |
| UNII | ES8C3884JW |
| HMDB ID | HMDB0257408 |
| Wikidata | Q27277336 |
| ChEMBL ID | CHEMBL356703 |
| PubChem CID | 5142 |
| Related CAS | 867-44-7（硫酸盐[2:1]） |
| Nikkaji Number | J62.826C |
| Pharos Ligand ID | YCG38LBXMC1T |
| DSSTox Substance ID | DTXSID60903780 |
| Metabolomics Workbench ID | 132023 |
| PubChem Reference Collection SID | 500824109 |
physicochemical properties
| XLogP3 | XLogP3-AA: 0.2 |
| 复杂性 | 42.9 |
| Exact Mass | 90.02516937 |
| 形式电荷 | 0 |
| 重原子计数 | 5 |
| Molecular Weight | 90.15 |
| Monoisotopic Mass | 90.02516937 |
| 可旋转键计数 | 1 |
| 氢键供体计数 | 2 |
| 氢键受体计数 | 2 |
| 共价键单元计数 | 1 |
| 同位素原子计数 | 0 |
| 拓扑极性表面积 | 75.2 Ų |
| 定义键立体中心计数 | 0 |
| 定义原子立体中心计数 | 0 |
| 未定义键立体中心计数 | 0 |
| 未定义原子手性中心计数 | 0 |
Safety information
No safety information yet
Production methods and uses
purpose
工业应用参考：
工业分类参考：计算机、通信和其他电子设备制造业。
应用场景参考：在环境监测、水资源分析、矿产检测、农残筛查和大气污染研究等方向具备潜在应用空间 。
作用参考：可作为基础工业材料参与合成、提纯或改性过程，为后续产品制造和工艺放大提供支撑 。
选型提示：精细化学品的稳定性不仅取决于材料本身，也与生产流程、仓储物流、追溯能力和管理水平密切相关 。
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MSDS
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