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Merck
CN

I2127

Isocytosine

≥99%

别名:

2-Amino-4-hydroxypyrimidine, 2-Aminouracil

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关于此项目

经验公式(希尔记法):
C4H5N3O
化学文摘社编号:
分子量:
111.10
UNSPSC Code:
41106305
PubChem Substance ID:
EC Number:
203-592-0
MDL number:
Assay:
≥99%
Biological source:
synthetic (organic)
Form:
powder
Solubility:
acetic acid: 50 mg/mL, clear, colorless
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InChI key

XQCZBXHVTFVIFE-UHFFFAOYSA-N

InChI

1S/C4H5N3O/c5-4-6-2-1-3(8)7-4/h1-2H,(H3,5,6,7,8)

SMILES string

NC1=NC=CC(=O)N1

biological source

synthetic (organic)

assay

≥99%

form

powder

solubility

acetic acid: 50 mg/mL, clear, colorless

Application

Isocytosine (2-aminouracil) is an isomer of cytosine used in physical chemical studies involving metal complex binding, hydrogen-bonding, and tautomerism and proton transfer effects in nucleobases.

pictograms

Exclamation mark

signalword

Warning

hcodes

Hazard Classifications

Acute Tox. 4 Oral - Eye Irrit. 2

存储类别

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

法规信息

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分析证书(COA)

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K J LaChance-Galang et al.
Inorganic chemistry, 40(3), 485-492 (2001-02-24)
Pentaammineruthenium moves on ambidentate nitrogen heterocycles by both rotation and linkage isomerization, which may affect the biological activity of potential ruthenium metallopharmaceuticals. The rapid rotation rates of [(NH3)5RuIII] coordinated to the exocyclic nitrogens of isocytosine (ICyt) and 6-methylisocytosine (6MeICyt) have
X L Yang et al.
Biophysical journal, 75(3), 1163-1171 (1998-09-03)
Isoguanine (2-hydroxyladenine) is a product of oxidative damage to DNA and has been shown to cause mutation. It is also a potent inducer of parallel-stranded DNA duplex structure. The structure of the parallel-stranded DNA duplex (PS-duplex) 5'-d(TiGiCAiCiGiGAiCT) + 5'-d(ACGTGCCTGA), containing
A Michael Sismour et al.
Nucleic acids research, 33(17), 5640-5646 (2005-09-30)
Synthetic biology based on a six-letter genetic alphabet that includes the two non-standard nucleobases isoguanine (isoG) and isocytosine (isoC), as well as the standard A, T, G and C, is known to suffer as a consequence of a minor tautomeric
Deepali Gupta et al.
Inorganic chemistry, 43(11), 3386-3393 (2004-05-25)
Isocytosine (ICH) exists in solution as two major tautomers, the keto form with N1 carrying a proton (1a) and the keto form with N3 being protonated (1b). In water, 1a and 1b exist in equilibrium with almost equal amounts of
Vitaliy Feyer et al.
The journal of physical chemistry. A, 115(26), 7722-7733 (2011-05-20)
Core-level X-ray photoemission and near-edge X-ray absorption fine structure spectra of 5-methylcytosine, 5-fluorocytosine, and isocytosine are presented and discussed with the aid of high-level ab initio calculations. The effects of the methylation, halogenation, and isomerization on the relative stabilities of

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