| 货号 (SKU) | 包装规格 | 是否现货 | 价格 | 数量 |
|---|---|---|---|---|
| A168697-1g |
1g |
期货  |
|
| 英文别名 | AKOS010944764 | TERT-BUTYL 4-AMINO-2-FLUOROPHENYLCARBAMATE | SCHEMBL2833050 | tert-Butyl (4-amino-2-fluorophenyl)carbamate | (4-Amino-2-fluoro-phenyl)-carbamic acid tert-butyl ester | SB35510 | MFCD09953033 | (4-Amino-2-fluoro-phenyl)-carbamic acid tert-b |
|---|---|
| 英文名称 | (4-Amino-2-fluoro-phenyl)-carbamic acid tert-butyl ester |
| 储存温度 | 室温 |
| 运输条件 | 常规运输 |
| IUPAC Name | tert-butyl N-(4-amino-2-fluorophenyl)carbamate |
|---|---|
| INCHI | InChI=1S/C11H15FN2O2/c1-11(2,3)16-10(15)14-9-5-4-7(13)6-8(9)12/h4-6H,13H2,1-3H3,(H,14,15) |
| InChi Key | WBYYPBQKOOBWAE-UHFFFAOYSA-N |
| Canonical SMILES | CC(C)(C)OC(=O)NC1=C(C=C(C=C1)N)F |
| Isomeric SMILES | CC(C)(C)OC(=O)NC1=C(C=C(C=C1)N)F |
| 分子量 | 226.25 |
| Reaxy-Rn | 15706958 |
| Reaxys-RN link address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=15706958&ln= |
| 分子量 | 226.250 g/mol |
|---|---|
| XLogP3 | 2.000 |
| 氢键供体数Hydrogen Bond Donor Count | 2 |
| 氢键受体数Hydrogen Bond Acceptor Count | 4 |
| 可旋转键计数Rotatable Bond Count | 3 |
| 精确质量Exact Mass | 226.112 Da |
| 单同位素质量Monoisotopic Mass | 226.112 Da |
| 拓扑极表面积Topological Polar Surface Area | 64.400 Ų |
| 重原子数Heavy Atom Count | 16 |
| 形式电荷Formal Charge | 0 |
| 复杂度Complexity | 253.000 |
| 同位素原子数Isotope Atom Count | 0 |
| 定义的原子立体中心计数Defined Atom Stereocenter Count | 0 |
| 未定义的原子立体中心计数Undefined Atom Stereocenter Count | 0 |
| 定义的键立体中心计数Defined Bond Stereocenter Count | 0 |
| 未定义的键立体中心计数Undefined Bond Stereocenter Count | 0 |
| 所有立体化学键的总数The total count of all stereochemical bonds | 0 |
| 共价键合单元计数Covalently-Bonded Unit Count | 1 |
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