6-(甲基氨基)-2(1h)-嘧啶酮

6-(甲基氨基)-2(1h)-嘧啶酮 基本信息
CAS号 6220-47-9 分子式 C5H7N3O
分子量 125.12900 精确质量  125.05900
PSA  57.78000 LogP  -0.11540

基本信息 展开↓

CAS号:
6220-47-9
3D弹球模型:
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分子式:
C5H7N3O
分子量:
125.12900
中文名称:
6-(甲基氨基)-2(1h)-嘧啶酮
英文名称:
N4-methylcytosine
中文别名:
6-(甲基氨基)-2(1h)-嘧啶酮;
N-甲基胞嘧啶;
potassium 4-nitrophenyl sulphate;
4-硝基苯基硫酸钾;
N-Benzyloxycarbonyl-L-valinol;
Cbz-L-Valinol;
Carbamic acid,N-[(1S)-1-(hydroxymethyl)-2-methylpropyl]-, phenylmethyl ester;
2-(4-Chlorophenyl)glycine;
DL-Para Clorine Phenylglycine;
2-amino-2-(4-chlorophenyl)acetic acid;
Chlorophenylglycine;
2-Cyano-3,3'-diphenyl acrylie acid-2-ethylhexyl ester;
2-ethylhexyl 2-cyano-3,3-diphenyl-acrylate;
tris(2-methylphenyl)phosphine;
but-2-en-1-ol;
6-Mercaptopurine Hydrate;
3,7-Dihydro-6H-Purine-6-Thione Hydrate;
1,4,5,7-Tetrahydro-6H-Purine-6-Thione Hydrate;
7H-Purine-6-Thiolate;
6-mercaptopurine monohydrate;
Acid Blue 90;
Brilliant Blue G;
Tetrachlorothiofene;
tetrachlorothiophene;
Tetrachlorthiofen;
Tetrachlorthiofen [Czech];
Thiophene, tetrachloro-;
N-(2-chloro-4-{[(1E)-(4-chlorophenyl)methylidene]amino}phenyl)-4-{[(1E)-(4-chlorophenyl)methylidene]amino}benzamide;
L(+)-Asparagine monohydrate;
2,9-dimethylisoquino[4',5',6':6,5,10]anthra[2,1,9-def]isoquinoline-1,3,8,10(2H,9H)-tetrone;
N,N'-dimethyl-3,4,9,10-perylenedicarboximide;
N,N'-Dimethyl-3,4,
英文别名:
N4-methylcytosine;
4-methylamino-1H-pyrimidin-2-one;
Cytidine,N-methyl;
4-N-Methylcytidine;
N(4)-methylcytosine;
6-(Methylamino)pyrimidin-2(1H)-one;
N4-methylcytidine;
N-methylcytosine;
N4-Methyl-cytidin;
N4-Methylcytosin;
4-Methylamino-1H-pyrimidin-2-on
精确分子量/精确质量:
125.05900
极性分子表面积/PSA:
57.78000
油水分配系数/LogP:

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值,反映了物质在油水两相中的分配情况。其中、LogP值越大,说明该物质越亲油;反之,LogP值越小,则说明该物质越亲水。
InChI:
InChI=1/C5H7N3O/c1-6-4-2-3-7-5(9)8-4/h2-3H,1H3,(H2,6,7,8,9)

物化性质

密度:
1.31g/cm3
沸点:
395ºC at 760 mmHg
闪点:
192.7ºC
折射率:
1.609

分子结构与计算化学数据展开↓

分子结构数据


1、  摩尔折射率:32.86

2、  摩尔体积(cm3/mol):94.7

3、  等张比容(90.2K):250.0

4、  表面张力(dyne/cm):48.3

5、  极化率(10-24cm3):13.02

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