[(3,4-Dihydroisoquinolin-2(1H)-yl)methylene]malononitrile (CAS 6687-82-7) — formula C13H11N3, molecular weight 209.25; category organic chemicals.
| CAS Number | 6687-82-7 |
|---|---|
| Molecular Formula | C13H11N3 |
| Molecular Weight | 209.25 |
| LogP | 1.8 |
| Category | Organic Chemicals |
[(3,4-Dihydroisoquinolin-2(1H)-yl)methylene]malononitrile is a carbon-based organic compound with CAS registry number 6687-82-7 and molecular formula C13H11N3 (molecular weight 209.25), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 6687-82-7
Its molecular formula C13H11N3 comprises 13 C, 11 H, 3 N atoms.
Also known as: [(3,4-Dihydroisoquinolin-2(1H)-yl)methylene]malononitrile · [(3,4-二氢异喹啉-2(1H)-基)亚甲基]丙二腈
Category: organic chemicals
The CAS registry number of [(3,4-Dihydroisoquinolin-2(1H)-yl)methylene]malononitrile is 6687-82-7.
Molecular formula C13H11N3, molecular weight 209.25.
It is also registered under: [(3,4-Dihydroisoquinolin-2(1H)-yl)methylene]malononitrile, [(3,4-二氢异喹啉-2(1H)-基)亚甲基]丙二腈.
Category: Organic Chemicals.
Independent reference data for [(3,4-Dihydroisoquinolin-2(1H)-yl)methylene]malononitrile (CAS 6687-82-7), compiled from public chemistry databases.
| CAS 号 | 6687-82-7 |
|---|---|
| PubChem CID | 23156 |
| 分子式 | C13H11N3 |
| IUPAC 名称 | 2-(3,4-dihydro-1H-isoquinolin-2-ylmethylidene)propanedinitrile |
| UNII（FDA） | EY92H3Z8BP |
| Molecular Weight | 209.25 |
|---|---|
| XLogP3 | 1.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 209.095297364 |
| Monoisotopic Mass | 209.095297364 |
| Topological Polar Surface Area | 50.8 |
| Heavy Atom Count | 16 |
6687-82-7; NSC 85626; BRN 1684679; MALONONITRILE, ((3,4-DIHYDRO-2(1H)-ISOQUINOLYL)METHYLENE)-; ((3,4-Dihydro-2(1H)-isoquinolyl)methylene)malononitrile; Propanedinitrile, ((3,4-dihydro-2(1H)-isoquinolinyl)methylene)-; [(3,4-Dihydro-2(1H)-isoquinolyl)methylene]malononitrile; Malononitrile, [(3,4-dihydro-2(1H)-isoquinolyl)methylene]-; RefChem:351852; Propanedinitrile, ((3,4-dihydro-2(1H)-isoquinolinyl)methylene)-(9CI); NSC-85626; 2-((3,4-dihydroisoquinolin-2(1H)-yl)methylene)malononitrile; F0418-0008; NSC85626; EY92H3Z8BP; DTXSID90985493
[(3,4-二氢异喹啉-2(1H)-基)亚甲基]丙二腈 · CAS 6687-82-7 · C13H11N3. UNII EY92H3Z8BP.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.