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About This Item
经验公式（希尔记法）:
C6H7N3O2
CAS号:
分子量:
153.14
Beilstein:
138451
MDL號碼:
分類程式碼代碼:
12352100
PubChem物質ID:
NACRES:
NA.22
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化驗
99%
mp
>300 °C (lit.)
SMILES 字串
CC(=O)NC1=NC(=O)NC=C1
InChI
1S/C6H7N3O2/c1-4(10)8-5-2-3-7-6(11)9-5/h2-3H,1H3,(H2,7,8,9,10,11)
InChI 密鑰
IJCKBIINTQEGLY-UHFFFAOYSA-N
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一般說明
Four stable conformers of N4-acetylcytosine, and the one of the stable form containing an intramoleuclar six-membered ring have been reported by theoretical calculations.The infrared and FT-Raman spectra of N4-acetylcytosine in the solid phase has been reported.
應用
N4-Acetylcytosine may be used in the preparation of cytidine. It may be used in the preparation of 1-(4-azido-4-deoxy-β-D-glucopyranosyl)cytosine.
儲存類別代碼
11 - Combustible Solids
水污染物質分類（WGK）
WGK 3
閃點（°F）
Not applicable
閃點（°C）
Not applicable
個人防護裝備
Eyeshields, Gloves, type N95 (US)
Synthesis and properties of N-(2, 3, 5-tri-O-acetyl-D-ribofuranosyl) maleimide.
Schwartz AL and Lerner LM.
The Journal of Organic Chemistry, 40(1), 24-28 (1975)
Dapeng Zhou et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 112, 139-145 (2013-05-15)
The infrared and FT-Raman spectra of N4-acetylcytosine in the solid phase have been recorded, and the molecular geometrical parameters were optimized using B3LYP and MP2 methods with 6-311++G(d,p) basis set. The theoretical calculations indicate the presence of four stable conformers
Nucleosides. 63. Synthetic studies on nucleoside antibiotics. 3. Total synthesis of 1-(4-amino-4-deoxy-beta-d-glucopyranosyluronic acid)cytosine, the nucleoside moiety of gougerotin.
K A Watanabe et al.
The Journal of organic chemistry, 35(1), 231-236 (1970-01-01)
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