7229-06-3 ((2,1,3-BENZOTHIADIAZOLE-5-PROPANOIC ACID, ALPHA-AMINO-4-NITRO-, HYDROCHLORIDE (1:1))

快速询单

结构式：

2,1,3-BENZOTHIADIAZOLE-5-PROPANOIC ACID, ALPHA-AMINO-4-NITRO-, HYDROCHLORIDE (1:1)MOL文件

CAS号：

7229-06-3

英文名称：

2,1,3-BENZOTHIADIAZOLE-5-PROPANOIC ACID, ALPHA-AMINO-4-NITRO-, HYDROCHLORIDE (1:1)

分子式：

C₇H₄IO₂

分子量：

247.009934425354

2,1,3-BENZOTHIADIAZOLE-5-PROPANOIC ACID, ALPHA-AMINO-4-NITRO-, HYDROCHLORIDE (1:1)(7229-06-3)名称与标识符

名称

英文别名：

2,1,3-BENZOTHIADIAZOLE-5-PROPANOIC ACID, ALPHA-AMINO-4-NITRO-, HYDROCHLORIDE (1:1);DTXCID00363783;7229-06-3;DTXSID50412932;3-iodobenzoate;

标识符

InChIKey：

KVBWBCRPWVKFQT-UHFFFAOYSA-M

Inchi：

1S/C7H5IO2/c8-6-3-1-2-5(4-6)7(9)10/h1-4H,(H,9,10)/p-1

SMILES：

IC1=CC=CC(C(=O)[O-])=C1

2,1,3-BENZOTHIADIAZOLE-5-PROPANOIC ACID, ALPHA-AMINO-4-NITRO-, HYDROCHLORIDE (1:1)(7229-06-3)物化性质

计算特性

精确分子量 : 246.92560Da
氢键供体数量 : 0
氢键受体数量 : 2
可旋转化学键数量 : 0
同位素质量 : 246.92560Da
重原子数量 : 10
复杂度 : 130
同位素原子数量 : 0
确定原子立构中心数量 : 0
不确定原子立构中心数量 : 0
确定化学键立构中心数量 : 0
不确定化学键立构中心数量 : 0
共价键单元数量 : 1
疏水参数计算参考值（XlogP） : 3.8
拓扑分子极性表面积 : 40.1Å²

2,1,3-BENZOTHIADIAZOLE-5-PROPANOIC ACID, ALPHA-AMINO-4-NITRO-, HYDROCHLORIDE (1:1)(7229-06-3)相关文献

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5. The development of phenylethylene dendrons for blue phosphorescent emitters
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7. Pd/P/dba-Promoted cascade annulations to produce fused medium-sized sulfoximine polyheterocycles
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960化工网为您提供2,1,3-BENZOTHIADIAZOLE-5-PROPANOIC ACID, ALPHA-AMINO-4-NITRO-, HYDROCHLORIDE (1:1)专业化合物百科信息，包括中文名，英文名，分子式，分子量，以及该化合物的CasNo.7229-06-3,相关理化性质;并提供了优质生产厂家信息包括厂家名称和联系方式等。 WAP版:7229-06-3 国际站:7229-06-3

7229-06-3 ((2,1,3-BENZOTHIADIAZOLE-5-PROPANOIC ACID, ALPHA-AMINO-4-NITRO-, HYDROCHLORIDE (1:1))

2,1,3-BENZOTHIADIAZOLE-5-PROPANOIC ACID, ALPHA-AMINO-4-NITRO-, HYDROCHLORIDE (1:1)(7229-06-3)名称与标识符

名称

标识符

2,1,3-BENZOTHIADIAZOLE-5-PROPANOIC ACID, ALPHA-AMINO-4-NITRO-, HYDROCHLORIDE (1:1)(7229-06-3)物化性质

计算特性

2,1,3-BENZOTHIADIAZOLE-5-PROPANOIC ACID, ALPHA-AMINO-4-NITRO-, HYDROCHLORIDE (1:1)(7229-06-3)相关文献

目录