1-(3-氯丙基)-4-甲基哌嗪 | 104-16-5
中文名称:
1-(3-氯丙基)-4-甲基哌嗪
英文名称:
1-(3-Chloropropyl)-4-methylpiperazine
CAS No.:
104-16-5
分子式:
C8 H1 7 N2 Cl
分子量:
176.68698
名称和标识符
MDL
MFCD00067335
InChIKey
AUERUDPETOKUPT-UHFFFAOYSA-N
Inchi
1S/C8H17ClN2/c1-10-5-7-11(8-6-10)4-2-3-9/h2-8H2,1H3
SMILES
C(N1CCN(C)CC1)CCCl
别名信息
- 中文别名 -
1-(3-氯丙基)-4-甲基哌嗪
地乐灵
1-甲基-4-(3-氯丙基)哌嗪
- 英文别名 -
1-(3-Chloropropyl)-4-methylpiperazine
N-(3-Chloropropyl)-N'-methylpiperazine
3-(4-Methylpiperazino)propyl chloride
1-(3-chloro-propyl)-4-methyl-piperazine
n-methylpiperazinopropyl chloride
1-Methyl-4-(3-chloropropyl)piperazine
1-(3-chloropropyl)-4-methyl-piperazin
1-(3-Chloroprop-1-yl)-4-methylpiperazine
1-Chloro-3-(4-Methyl-1-piperazinyl)propane
1-(3-chloropropyl)-4-methylpiperazine
DS-11946
3-(4-Methyl-1-piperazinyl)propyl chloride
SCHEMBL167231
AKOS000265260
AE-848/33829046
W-206500
NS00023283
W-204526
MFCD00067335
AUERUDPETOKUPT-UHFFFAOYSA-N
N-Methylpiperazinopropyl chloride
1-methyl-4-(3-chloropropyl)piperazine
5-23-01-00141 (Beilstein Handbook Reference)
AB90755
3-(4-methylpiperazino)propyl chloride
Piperazine, 1-(3-chloropropyl)-4-methyl-
DTXSID90146204
EINECS 203-181-6
1-Chloro-3-[4-Methylpiperazin-1yl]Propane
1-Chloro-3-(4-methyl-1-piperazinyl)propane
1-(3-Chloro-propyl)-4-methyl-piperazine
FT-0605620
104-16-5
HM8PR2X8WU
BRN 0106074
物化性质
实验特性
LogP
0.73850
PSA
6.48000
折射率
1.476
沸点
243 ºC
闪点
101 ºC
密度
1.015
计算特性
精确分子量
176.10800
氢键供体数量
0
氢键受体数量
2
可旋转化学键数量
3
同位素质量
176.1080262g/mol
重原子数量
11
复杂度
100
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
互变异构体数量
无
表面电荷
0
拓扑分子极性表面积
6.5Ų
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.
467. 6-Methoxy-8-(ω-piperazin-1′-ylalkylamino)quinolines
P. A. Barrett,A. G. Caldwell,L. P. Walls J. Chem. Soc. 1961 2404
2.
Comparative characterization of amino acids in Abelmoschus manihot roots, stems and leaves during different growth periods by UPLC-TQ-MS/MS
Le-yue Du,Da-wei Qian,Shu Jiang,Jian-ming Guo,Shu-lan Su,Jin-ao Duan Anal. Methods 2015 7 10280
3.
Design, synthesis and characterization of novel chromone based-copper(ii) antitumor agents with N,N-donor ligands: comparative DNA/RNA binding profile and cytotoxicity
Farukh Arjmand,Zeenat Afsan,Thierry Roisnel RSC Adv. 2018 8 37375
4.
XXXVII.—On the reduction of the oxides of nitrogen by metallic copper in organic analysis
W. Thorp J. Chem. Soc. 1866 19 359
5.
Intramolecular hydrogen bonding in hydroxy-keto-steroids
T. Suga,T. Shishibori,T. Matsuura J. Chem. Soc. Perkin Trans. 1 1972 171
6.
Intramolecular hydrogen bonding in hydroxy-keto-steroids
T. Suga,T. Shishibori,T. Matsuura J. Chem. Soc. Perkin Trans. 1 1972 171
7.
Reactions of the isopropoxyl radical. Part II. Pressure dependence and kinetics of pyrolysis at 160–200° in the gas phase
D. L. Cox,R. A. Livermore,L. Phillips J. Chem. Soc. B 1966 245
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