6-Chloro-1H-pyrazolo[3,4-d]pyrimidin-4(7H)-one (CAS 42754-97-2) — formula C5H3ClN4O, molecular weight 170.56; category organic chemicals.
| CAS Number | 42754-97-2 |
|---|---|
| Molecular Formula | C5H3ClN4O |
| Molecular Weight | 170.56 |
| LogP | 0.4 |
| Category | Organic Chemicals |
6-Chloro-1H-pyrazolo[3,4-d]pyrimidin-4(7H)-one is a carbon-based organic compound with CAS registry number 42754-97-2 and molecular formula C5H3ClN4O (molecular weight 170.56), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 42754-97-2
Its molecular formula C5H3ClN4O comprises 5 C, 3 H, 1 Cl, 4 N, 1 O atoms.
Also known as: 6-Chloro-1H-pyrazolo[3,4-d]pyrimidin-4(7H)-one · 6-氯-1H-吡唑并[3,4-d]嘧啶-4(7H)-酮
Category: organic chemicals
The CAS registry number of 6-Chloro-1H-pyrazolo[3,4-d]pyrimidin-4(7H)-one is 42754-97-2.
Molecular formula C5H3ClN4O, molecular weight 170.56.
It is also registered under: 6-Chloro-1H-pyrazolo[3,4-d]pyrimidin-4(7H)-one, 6-氯-1H-吡唑并[3,4-d]嘧啶-4(7H)-酮.
Category: Organic Chemicals.
Independent reference data for 6-Chloro-1H-pyrazolo[3,4-d]pyrimidin-4(7H)-one (CAS 42754-97-2), compiled from public chemistry databases.
| CAS 号 | 42754-97-2 |
|---|---|
| PubChem CID | 135408757 |
| 分子式 | C5H3ClN4O |
| IUPAC 名称 | 6-chloro-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one |
| Molecular Weight | 170.56 |
|---|---|
| XLogP3 | 0.4 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 0 |
| Exact Mass | 169.9995384 |
| Monoisotopic Mass | 169.9995384 |
| Topological Polar Surface Area | 70.1 |
| Heavy Atom Count | 11 |
6-chloro-1H,4H,7H-pyrazolo[3,4-d]pyrimidin-4-one; 6-chloro-1H,4H,7H-pyrazolo(3,4-d)pyrimidin-4-one; RefChem:541424; 866-129-7; 42754-97-2; 6-Chloro-1H-pyrazolo[3,4-d]pyrimidin-4(7H)-one; MFCD18793418; 335389-60-1; 6-chloro-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one; 6-Chloro-1H-pyrazolo[3,4-d]pyrimidin-4(2H)-one; 6-chloro-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one; 6-chloro-1,5-dihydropyrazolo[3,4-d]pyrimidin-4-one; 6-chloro-1,2-dihydro-4h-pyrazolo[3,4-d]pyrimidin-4-one; 6-Chloro-1H-pyrazolo[3,4-d]pyrimidin-4-ol; NSC7848; 6-Chloro-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one
| 已通报的危害声明 | H315 (100%), H319 (100%), H335 (100%) |
|---|
6-氯-1H-吡唑并[3,4-d]嘧啶-4(7H)-酮 · CAS 42754-97-2 · C5H3ClN4O.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.