3-methylsulfanyl-2,4,8,9-tetrazabicyclo[4.3.0]nona-1,3,5,7-tetraen-5-a mine (CAS 5444-29-1) — formula C6H7N5S, molecular weight 181.22; category organic chemicals.
| CAS Number | 5444-29-1 |
|---|---|
| Molecular Formula | C6H7N5S |
| Molecular Weight | 181.22 |
| LogP | 0.7 |
| Category | Organic Chemicals |
3-methylsulfanyl-2,4,8,9-tetrazabicyclo[4.3.0]nona-1,3,5,7-tetraen-5-a mine is a carbon-based organic compound with CAS registry number 5444-29-1 and molecular formula C6H7N5S (molecular weight 181.22), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 5444-29-1
Its molecular formula C6H7N5S comprises 6 C, 7 H, 5 N, 1 S atoms.
Also known as: 3-methylsulfanyl-2,4,8,9-tetrazabicyclo[4.3.0]nona-1,3,5,7-tetraen-5-a mine · 4-氨基-2-(甲基巯基)-7H-吡唑[2,3-d]嘧啶
Category: organic chemicals
The CAS registry number of 3-methylsulfanyl-2,4,8,9-tetrazabicyclo[4.3.0]nona-1,3,5,7-tetraen-5-a mine is 5444-29-1.
Molecular formula C6H7N5S, molecular weight 181.22.
It is also registered under: 3-methylsulfanyl-2,4,8,9-tetrazabicyclo[4.3.0]nona-1,3,5,7-tetraen-5-a mine, 4-氨基-2-(甲基巯基)-7H-吡唑[2,3-d]嘧啶.
Category: Organic Chemicals.
Independent reference data for 3-methylsulfanyl-2,4,8,9-tetrazabicyclo[4.3.0]nona-1,3,5,7-tetraen-5-a mine (CAS 5444-29-1), compiled from public chemistry databases.
| CAS 号 | 5444-29-1 |
|---|---|
| PubChem CID | 227469 |
| 分子式 | C6H7N5S |
| IUPAC 名称 | 6-methylsulfanyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine |
| UNII（FDA） | HMS3095K08 |
| Molecular Weight | 181.22 |
|---|---|
| XLogP3 | 0.7 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 1 |
| Exact Mass | 181.04221642 |
| Monoisotopic Mass | 181.04221642 |
| Topological Polar Surface Area | 106 |
| Heavy Atom Count | 12 |
5444-29-1; 6-(Methylthio)-1H-pyrazolo[3,4-d]pyrimidin-4-amine; 6-methylsulfanyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine; MLS002638653; SCHEMBL446779; DTXSID30280914; HMS3095K08; MFCD12196519; NSC 19067; AKOS006344572; SMR001548123; 3-METHYLSULFANYL-2,4,8,9-TETRAZABICYCLO[4.3.0]NONA-1,3,5,7-TETRAEN-5-A MINE; NSC19067; 6-(methylsulfanyl)-1h-pyrazolo[3,4-d]pyrimidin-4-amine; CHEMBL1905829; NSC-19067
4-氨基-2-(甲基巯基)-7H-吡唑[2,3-d]嘧啶 · CAS 5444-29-1 · C6H7N5S. UNII HMS3095K08.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.