[3-(diaminomethylidenecarbamoylamino)phenyl]boronic acid hydrochloride (CAS 74051-54-0) — formula C8H12BClN4O3, molecular weight 258.47; category organic chemicals.
[3-(diaminomethylidenecarbamoylamino)phenyl]boronic acid hydrochloride is a carbon-based organic compound with CAS registry number 74051-54-0 and molecular formula C8H12BClN4O3 (molecular weight 258.47), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 74051-54-0
Its molecular formula C8H12BClN4O3 comprises 8 C, 12 H, 1 B, 1 Cl, 4 N, 3 O atoms.
Also known as: [3-(diaminomethylidenecarbamoylamino)phenyl]boronic acid hydrochloride · [3-(二氨基亚甲基氨基甲酰氨基)苯基]硼酸盐酸盐
Category: organic chemicals
The CAS registry number of [3-(diaminomethylidenecarbamoylamino)phenyl]boronic acid hydrochloride is 74051-54-0.
Molecular formula C8H12BClN4O3, molecular weight 258.47.
It is also registered under: [3-(diaminomethylidenecarbamoylamino)phenyl]boronic acid hydrochloride, [3-(二氨基亚甲基氨基甲酰氨基)苯基]硼酸盐酸盐.
Category: Organic Chemicals.
Public-database records for [3-(diaminomethylidenecarbamoylamino)phenyl]boronic acid hydrochloride (CAS 74051-54-0), reproduced here for independent cross-checking.
| CAS 号 | 74051-54-0 |
|---|---|
| PubChem CID | 3057574 |
| 分子式 | C8H12BClN4O3 |
| IUPAC 名称 | [3-(diaminomethylidenecarbamoylamino)phenyl]boronic acid;hydrochloride |
1-Amidino-3-m-boronophenylurea hydrochloride; 74051-54-0; Urea, 1-amidino-3-(m-boronophenyl)-, hydrochloride; DTXSID00224961; RefChem:387568; DTXCID30147452; (3-{[(Diaminomethylidene)carbamoyl]amino}phenyl)boronic acid--hydrogen chloride (1/1)
| 分子量 | 258.47 |
|---|---|
| 氢键供体数 | 6 |
| 氢键受体数 | 3 |
| 可旋转键数 | 2 |
| 精确质量 | 258.0690981 |
| 单同位素质量 | 258.0690981 |
| 拓扑极性表面积 | 134 |
| 重原子数 | 17 |
| 形式电荷 | 0 |
| 复杂度 | 280 |
[3-(二氨基亚甲基氨基甲酰氨基)苯基]硼酸盐酸盐 · CAS 74051-54-0 · C8H12BClN4O3.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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