479969
4-氨基-5-嘧啶甲腈
96%
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关于此项目
经验公式（希尔记法）:
C5H4N4
化学文摘社编号:
分子量:
120.11
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
96%
Form:
solid
assay
96%
form
solid
mp
251-255 °C (lit.)
functional group
nitrile
SMILES string
Nc1ncncc1C#N
InChI
1S/C5H4N4/c6-1-4-2-8-3-9-5(4)7/h2-3H,(H2,7,8,9)
InChI key
JAIYUIOGVNRXEW-UHFFFAOYSA-N
General description
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.
Application
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.
signalword
Danger
Hazard Classifications
Acute Tox. 4 Oral - Eye Dam. 1 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3
target_organs
Respiratory system
存储类别
11 - Combustible Solids
wgk
WGK 3
ppe
dust mask type N95 (US), Eyeshields, Faceshields, Gloves
法规信息
新产品
此项目有
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)
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)
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)
全球贸易项目编号
| 货号 | GTIN |
|---|---|
| 479969-1G | 04061826222850 |
| 479969-5G | 04061832373492 |