3-chloro-9-methyl-N-phenethyl-2,4,8,9-tetrazabicyclo[4.3.0]nona-1,3,5, 7-tetraen-5-amine (CAS 6958-86-7) — formula C14H14ClN5, molecular weight 287.75; category organic chemicals.
| CAS Number | 6958-86-7 |
|---|---|
| Molecular Formula | C14H14ClN5 |
| Molecular Weight | 287.75 |
| LogP | 3.4 |
| Category | Organic Chemicals |
3-chloro-9-methyl-N-phenethyl-2,4,8,9-tetrazabicyclo[4.3.0]nona-1,3,5, 7-tetraen-5-amine is a carbon-based organic compound with CAS registry number 6958-86-7 and molecular formula C14H14ClN5 (molecular weight 287.75), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 6958-86-7
Its molecular formula C14H14ClN5 comprises 14 C, 14 H, 1 Cl, 5 N atoms.
Also known as: 3-chloro-9-methyl-N-phenethyl-2,4,8,9-tetrazabicyclo[4.3.0]nona-1,3,5, 7-tetraen-5-amine · 3-氯-9-甲基-N-苯乙基-2,4,8,9-四氮杂双环[4.3.0]壬-1,3,5,7-四烯-5-胺
Category: organic chemicals
The CAS registry number of 3-chloro-9-methyl-N-phenethyl-2,4,8,9-tetrazabicyclo[4.3.0]nona-1,3,5, 7-tetraen-5-amine is 6958-86-7.
Molecular formula C14H14ClN5, molecular weight 287.75.
It is also registered under: 3-chloro-9-methyl-N-phenethyl-2,4,8,9-tetrazabicyclo[4.3.0]nona-1,3,5, 7-tetraen-5-amine, 3-氯-9-甲基-N-苯乙基-2,4,8,9-四氮杂双环[4.3.0]壬-1,3,5,7-四烯-5-胺.
Category: Organic Chemicals.
Independent reference data for 3-chloro-9-methyl-N-phenethyl-2,4,8,9-tetrazabicyclo[4.3.0]nona-1,3,5, 7-tetraen-5-amine (CAS 6958-86-7), compiled from public chemistry databases.
| CAS 号 | 6958-86-7 |
|---|---|
| PubChem CID | 227530 |
| 分子式 | C14H14ClN5 |
| IUPAC 名称 | 6-chloro-1-methyl-N-(2-phenylethyl)pyrazolo[3,4-d]pyrimidin-4-amine |
| UNII（FDA） | HMS3095O20 |
| Molecular Weight | 287.75 |
|---|---|
| XLogP3 | 3.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 287.0937732 |
| Monoisotopic Mass | 287.0937732 |
| Topological Polar Surface Area | 55.6 |
| Heavy Atom Count | 20 |
NSC19139; 6958-86-7; 6-chloro-1-methyl-N-(2-phenylethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine; MLS002638676; NSC-19139; NCIStruc1_000379; NCIStruc2_000459; CHEMBL1452389; SCHEMBL13100622; BDBM32630; DTXSID20280943; HMS3095O20; NCI19139; 6-chloro-1-methyl-N-(2-phenylethyl)pyrazolo[3,4-d]pyrimidin-4-amine; CCG-37997; NCGC00013256
3-氯-9-甲基-N-苯乙基-2,4,8,9-四氮杂双环[4.3.0]壬-1,3,5,7-四烯-5-胺 · CAS 6958-86-7 · C14H14ClN5. UNII HMS3095O20.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.