5-溴-2,4-二氯嘧啶 | 36082-50-5
中文名称:
5-溴-2,4-二氯嘧啶
英文名称:
5-Bromo-2,4-dichloropyrimidine
CAS No.:
36082-50-5
分子式:
C4 HBrCl2 N2
分子量:
227.8741
名称和标识符
MDL
MFCD00127818
InChIKey
SIKXIUWKPGWBBF-UHFFFAOYSA-N
Inchi
1S/C4HBrCl2N2/c5-2-1-8-4(7)9-3(2)6/h1H
SMILES
BrC1=C([H])N=C(N=C1Cl)Cl
BRN
124441
别名信息
- 中文别名 -
5-溴-2,4-二氯嘧啶
2,4-二氯-5-溴嘧啶
5-Bromo-2,4-dichloropyrimidine 5-溴-2,4-二氯嘧啶
5-溴2,4-二氯嘧啶
- 英文别名 -
5-bromo-2,4-dichloropyrimidine
BUTTPARK 48\06-22
2,4-DICHLORO-5-BROMO PYRIMIDINE
TIMTEC-BB SBB003301
5-Bromo-2,4-Dichloropyridimidine
2,4-Dichloro-5-bromopyrimidine
See B684030
2,4-Dichloro-5-bromopyrimidineSee B684030
5-Bromo-2,4-dichloropyrimidine
See D433775
2,4,4-TRIMETHYLCYCLOPENTANONE
5-Brom-2,4-dichlor-pyrimidin
5-bromo-2,4-dichloropyrimdine
5-Bromo-2,4-dichloro-pyrimidine
5-Bromo-2,4-dichloror-pyrimidine
2,4-dichloro-5-bromopyrimidine
PYRIMIDINE, 5-BROMO-2,4-DICHLORO-
SIKXIUWKPGWBBF-UHFFFAOYSA-N
2,4-Dichloro-5-bormopyrimidine
NSC152517
zlchem 380
PubChem3993
KSC226I5J
5-bromo-2,4dichloropyrimidine
5-bromo-2,4-dichlorpyrimidine
5-bromo-2,4dichloro-pyrimidine
2,6-dichloro-5-bromopyrimidine
SIKXIUWKP
W-202499
AB03550
F2108-0250
Palbociclib impurity 99
DTXSID40302656
FT-0700569
5-Bromo-2,4-dichloropyrimidine, 97%
5-bromanyl-2,4-bis(chloranyl)pyrimidine
InChI=1/C4HBrCl2N2/c5-2-1-8-4(7)9-3(2)6/h1H
MFCD00127818
FT-0620073
BCP22990
SIKXIUWKPGWBBF-UHFFFAOYSA-
PS-6296
AKOS002663027
5-bromo-2, 4-dichloropyrimidine
EN300-71646
NSC 152517
5-Bromo-2,4-dichloropyrimidine
2,4-Dichloro-5-bromo pyrimidine
CS-D1117
Z1142701237
SCHEMBL217854
AM20090573
A823117
A6265
36082-50-5
NSC-152517
B2823
AF-399/25108039
AC-3063
Discontinued, see D433775
5-Bromo-2,4-Dichloropyrimidine,98%
物化性质
实验特性
LogP
2.54590
PSA
25.78000
折射率
n20/D 1.603(lit.)
沸点
128 °C/15 mmHg(lit.)
熔点
29-30 °C (lit.)
闪点
华氏:235.4 °F 摄氏:113 °C
颜色与性状
固体
溶解性
不能溶解的
密度
1.781 g/mL at 25 °C(lit.)
计算特性
精确分子量
225.87000
氢键供体数量
0
氢键受体数量
2
可旋转化学键数量
0
同位素质量
225.87
重原子数量
9
复杂度
103
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)
2.8
互变异构体数量
无
表面电荷
0
拓扑分子极性表面积
25.8
海关数据
海关编码
2933599090
海关数据
中国海关编码:
2933599090
概述:
2933599090. 其他结构上有嘧啶环的化合物(包括其他结构上有哌嗪环的化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%
申报要素:
品名, 成分含量, 用途, 乌洛托品请注明外观, 6-己内酰胺请注明外观, 签约日期
Summary:
2933599090. other compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
相关文献
1.
Preparation, in vitro and in vivo evaluation, and molecular dynamics (MD) simulation studies of novel F-18 labeled tumor imaging agents targeting focal adhesion kinase (FAK)
Yu Fang,Dawei Wang,Xingyu Xu,Gila Dava,Jianping Liu,Xiang Li,Qianqian Xue,Huan Wang,Jiangshan Zhang,Huabei Zhang RSC Adv. 2018 8 10333
2.
Conversion of 2-deoxy-d-ribose into 2-amino-5-(2-deoxy-β-d-ribofuranosyl)pyridine, 2′-deoxypseudouridine, and other C-(2′-deoxyribonucleosides)
Colin B. Reese,Qinpei Wu Org. Biomol. Chem. 2003 1 3160
3.
A synthesis of pseudouridine and of 5-β-D-ribofuranosyluridine
D. M. Brown,M. G. Burdon,R. P. Slatcher J. Chem. Soc. C 1968 1051
4.
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5.
623. Pyrimidines. Part VI. 5-Bromopyrimidine
J. F. W. McOmie,I. M. White J. Chem. Soc. 1953 3129
6.
Pyrimidines. Part VIII. Halogeno- and hydrazino-pyrimidines
J. Chesterfield,J. F. W. McOmie,E. R. Sayer J. Chem. Soc. 1955 3478
7.
Studies on the synthesis of the derivatives of 5-(dihydroxyboryl)-cytosines and -isocytosines
Hanna Wojtowicz-Rajchel,Marek Suchowiak,Piotr Fiedorow,Krzysztof Golankiewicz J. Chem. Soc. Perkin Trans. 2 1998 841
8.
Notes
H. Bader,J. D. Downer,D. Gibbons,T. P. C. Mulholland,G. Ward,D. J. Brown,Norman Whittaker,A. M. Spivey,J. M. Osbond J. Chem. Soc. 1953 1641
9.
Notes
H. Bader,J. D. Downer,D. Gibbons,T. P. C. Mulholland,G. Ward,D. J. Brown,Norman Whittaker,A. M. Spivey,J. M. Osbond J. Chem. Soc. 1953 1641
参考资料
Reaxys RN
124441
Beilstein
23(5)5,348
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