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About This Item
經驗公式（希爾表示法）:
C5H4N4
CAS號碼:
分子量：:
120.11
MDL號碼:
分類程式碼代碼:
12352100
PubChem物質ID:
NACRES:
NA.22
推薦產品
化驗
96%
形狀
solid
mp
251-255 °C (lit.)
SMILES 字串
Nc1ncncc1C#N
InChI
1S/C5H4N4/c6-1-4-2-8-3-9-5(4)7/h2-3H,(H2,7,8,9)
InChI 密鑰
JAIYUIOGVNRXEW-UHFFFAOYSA-N
一般說明
4-Amino-5-pyrimidinecarbonitrile (APC) is a pyrimidine derivative that has been synthesized via three-component reaction between benzaldehyde, benzamidine hydrochloride and malononitrile. The infrared, 1H NMR, 13C NMR and mass spectra of APC have been recorded.
應用
4-Amino-5-pyrimidinecarbonitrile may be used as a monodentate ligand to prepare metal complexes of Co(II), Ni(II), Cu(II) and Pd(II) ions. It may be used as a reactant to prepare 1H-pyrimido[4,5-d]pyrimidine-2,4-dione.
訊號詞
Danger
危險分類
Acute Tox. 4 Oral - Eye Dam. 1 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3
標靶器官
Respiratory system
儲存類別代碼
11 - Combustible Solids
水污染物質分類（WGK）
WGK 3
個人防護裝備
dust mask type N95 (US), Eyeshields, Faceshields, Gloves
分析證明 (COA)
輸入產品批次/批號來搜索 分析證明 (COA)。在產品’s標籤上找到批次和批號，寫有 ‘Lot’或‘Batch’.。
Synthesis, antimicrobial activity, structural and spectral characterization and DFT calculations of Co (II), Ni (II), Cu (II) and Pd (II) complexes of 4-amino-5-pyrimidinecarbonitrile.
Mohamed TA, et al.
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy, 135, 417-427 (2015)
Infrared and NMR spectra, tautomerism, vibrational assignment, normal coordinate analysis, and quantum mechanical calculations of 4-amino-5-pyrimidinecarbonitrile.
Afifi MS, et al.
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy, 111, 277-289 (2013)
Synthesis of quinazoline-2,4(1H,3H)-diones from carbon dioxide and 2-aminobenzonitriles using [Bmim]OH as a homogeneous recyclable catalyst.
Patil YP, et al.
Catalysis Today, 148(3), 355-360 (2009)
Three-component process for the synthesis of 4-amino-5-pyrimidinecarbonitriles under thermal aqueous conditions or microwave irradiation.
Sheibani H, et al.
ARKIVOC (Gainesville, FL, United States), 2, 115-123 (2008)
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