3-AMINO-6-(CHLOROMETHYL)-2-PYRAZINECARBONITRILE 4-OXIDE (CAS 40127-89-7) — formula C6H5ClN4O, molecular weight 184.58; category organic chemicals.
| CAS Number | 40127-89-7 |
|---|---|
| Molecular Formula | C6H5ClN4O |
| Molecular Weight | 184.58 |
| LogP | -0.4 |
| Category | Organic Chemicals |
3-AMINO-6-(CHLOROMETHYL)-2-PYRAZINECARBONITRILE 4-OXIDE is a carbon-based organic compound with CAS registry number 40127-89-7 and molecular formula C6H5ClN4O (molecular weight 184.58), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 40127-89-7
Its molecular formula C6H5ClN4O comprises 6 C, 5 H, 1 Cl, 4 N, 1 O atoms.
Also known as: 3-AMINO-6-(CHLOROMETHYL)-2-PYRAZINECARBONITRILE 4-OXIDE · 3-氨基-6-(氯甲基)-2-吡嗪甲腈-4-氧化物
Category: organic chemicals
The CAS registry number of 3-AMINO-6-(CHLOROMETHYL)-2-PYRAZINECARBONITRILE 4-OXIDE is 40127-89-7.
Molecular formula C6H5ClN4O, molecular weight 184.58.
It is also registered under: 3-AMINO-6-(CHLOROMETHYL)-2-PYRAZINECARBONITRILE 4-OXIDE, 3-氨基-6-(氯甲基)-2-吡嗪甲腈-4-氧化物.
Category: Organic Chemicals.
Independent reference data for 3-AMINO-6-(CHLOROMETHYL)-2-PYRAZINECARBONITRILE 4-OXIDE (CAS 40127-89-7), compiled from public chemistry databases.
| CAS 号 | 40127-89-7 |
|---|---|
| PubChem CID | 590834 |
| 分子式 | C6H5ClN4O |
| IUPAC 名称 | 6-(chloromethyl)-4-hydroxy-3-iminopyrazine-2-carbonitrile |
| UNII（FDA） | NS00057014 |
| Molecular Weight | 184.58 |
|---|---|
| XLogP3 | -0.4 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 1 |
| Exact Mass | 184.0151885 |
| Monoisotopic Mass | 184.0151885 |
| Topological Polar Surface Area | 83.5 |
| Heavy Atom Count | 12 |
Pyrazinecarbonitrile, 3-amino-6-(chloromethyl)-, 4-oxide; EINECS 254-799-8; 3-Amino-6-chloromethyl-2-(pyrazin-4-oxide)carbonitrile; 2-Pyrazinecarbonitrile, 3-amino-6-(chloromethyl)-, 4-oxide; RefChem:497472; 254-799-8; 40127-89-7; 3-Amino-6-(chloromethyl)-2-pyrazinecarbonitrile 4-oxide; 2-Amino-3-cyano-5-chloromethylpyrazine-1-oxide; 6-(chloromethyl)-4-hydroxy-3-iminopyrazine-2-carbonitrile; 2-amino-5-(chloromethyl)-3-cyanopyrazin-1-ium-1-olate; 3-amino-6-(chloromethyl)-4-hydroxypyrazine-2-carbonitrile; MFCD00006123; AURORA KA-6221; SCHEMBL2490318; TIMTEC-BB SBB000247
| 已通报的危害声明 | H302 (100%), H312 (100%), H315 (100%), H319 (100%), H332 (100%), H335 (100%) |
|---|
3-氨基-6-(氯甲基)-2-吡嗪甲腈-4-氧化物 · CAS 40127-89-7 · C6H5ClN4O. UNII NS00057014.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.