2942-36-1 ((5-Nitrocinnoline)

快速询单

结构式：

5-NitrocinnolineMOL文件

CAS号：

2942-36-1

英文名称：

5-Nitrocinnoline

分子式：

C₈H₅N₃O₂

分子量：

175.144201040268

5-Nitrocinnoline(2942-36-1)名称与标识符

名称

英文别名：

5-Nitrocinnoline;5-(Hydroxy(oxido)amino)cinnoline;5-Nitro-cinnolin;5-nitro-cinnoline;AC1L8T3W;ANW-70469;Cinnoline, 5-nitro-;CTK0J1320;NSC680493;NCI60_028702;NSC-680493;CAA94236;AKOS016002432;2942-36-1;DTXSID00327724;CHEMBL1974633;SCHEMBL11217287;

标识符

InChIKey：

CPVUBWULXBRCAQ-UHFFFAOYSA-N

Inchi：

1S/C8H5N3O2/c12-11(13)8-3-1-2-7-6(8)4-5-9-10-7/h1-5H

SMILES：

[O-][N+](C1=CC=CC2=C1C=CN=N2)=O

5-Nitrocinnoline(2942-36-1)物化性质

实验特性

PSA : 68.92

计算特性

精确分子量 : 175.03825
氢键供体数量 : 0
氢键受体数量 : 2
可旋转化学键数量 : 1
同位素质量 : 175.038176411g/mol
重原子数量 : 13
复杂度 : 204
同位素原子数量 : 0
确定原子立构中心数量 : 0
不确定原子立构中心数量 : 0
确定化学键立构中心数量 : 0
不确定化学键立构中心数量 : 0
共价键单元数量 : 1
疏水参数计算参考值（XlogP） : 1
拓扑分子极性表面积 : 71.6Å²

5-Nitrocinnoline(2942-36-1)安全信息

储存条件： Sealed in dry,2-8°C

5-Nitrocinnoline(2942-36-1)推荐厂家更多厂家(2)

公司名称	手机号/电话	联系人	QQ	微信	询单
上海瀚思化工有限公司	18939883912 021-34536277	顾经理	3003949364		询单
江苏艾康生物医药研发有限公司	18795912720 025-66061636	杨情情	3004779232		询单

5-Nitrocinnoline(2942-36-1)相关文献

1. 440. Cinnolines. Part XXVII. The preparation and nitration of cinnoline
J. S. Morley J. Chem. Soc. 1951 1971
2. Heteroaromatic reactivity. Part III. The kinetics of nitration of cinnoline and 2-methylcinnolinium perchlorate
R. B. Moodie,E. A. Qureshi,K. Schofield,J. T. Gleghorn J. Chem. Soc. B 1968 312
3. A new cinnoline synthesis. Part IV. Nitration and sulphonation of chloro-(5,6,7,8)-4-hydroxy-cinnolines
E. Lunt,K. Washbourn,W. R. Wragg J. Chem. Soc. C 1968 687
4. Heteroaromatic reactivity. Part IV. The kinetics of nitration of cinnoline 2-oxide and quinoline 1-oxide in sulphuric acid. The mechanism of nitration of N-heteroaromatic oxides, with special reference to 2,6-lutidine 1-oxide
J. T. Gleghorn,R. B. Moodie,E. A. Qureshi,K. Schofield J. Chem. Soc. B 1968 316
5. Cinnolines. Part VIII. Methylation of some substituted cinnolines
D. E. Ames,R. F. Chapman,D. Waite J. Chem. Soc. C 1966 470
6. 123. Cinnolines. Part XXX. The nature of the C(3)-position. The synthesis of 3-methyl-, 3-chloro-, and 3-bromo-cinnoline; also, of cinnoline and the Bz-nitrocinnolines
E. J. Alford,K. Schofield J. Chem. Soc. 1953 609
7. Heteroaromatic reactivity. Part VI. Kinetics and products of the nitration of 4-hydroxyquinoline, 1-methyl-4-quinolone, 4-methoxyquinoline, and 4-hydroxycinnoline in sulphuric acid
R. B. Moodie,J. R. Penton,K. Schofield J. Chem. Soc. B 1971 1493
8. 959. Steric hindrance in Analytical Chemistry. Part VI. 1-Methyl- and 1,6-dimethyl-3,4,5-triazaphenanthrene as reagents for iron and copper
E. A. Hobday,Muriel Tomlinson,H. Irving J. Chem. Soc. 1962 4914
9. 490. Electrophilic substitution. Part XI. Nitration of some six-membered nitrogen-heterocyclic compounds in sulphuric acid
M. J. S. Dewar,P. M. Maitlis J. Chem. Soc. 1957 2521