2-苯基咪唑啉 | 936-49-2
中文名称:
2-苯基咪唑啉
英文名称:
2-Phenyl-2-imidazoline
CAS No.:
936-49-2
分子式:
C9 H1 0 N2
分子量:
146.189101696014
名称和标识符
MDL
MFCD00005180
InChIKey
BKCCAYLNRIRKDJ-UHFFFAOYSA-N
Inchi
1S/C9H10N2/c1-2-4-8(5-3-1)9-10-6-7-11-9/h1-5H,6-7H2,(H,10,11)
SMILES
N1CCNC=1C1C=CC=CC=1
别名信息
- 中文别名 -
2-苯基咪唑啉
2-苯基-2-咪唑啉
2-苯基-4,5-二氢-1H-咪唑
2-苯基-4,5-二氢化咪唑
- 英文别名 -
2-Phenyl-4,5-dihydro-1H-imidazole
2-Phenylimidazoline
2-Phenyl-2-imidazoline
4,5-Dihydro-2-phenyl-1H-imidazole
2-Imidazoline,2-phenyl- (6CI,7CI,8CI)
2-Phenyl-4,5-dihydroimidazole
2PZ-L
B 31
Curezol2PZ-L
NSC 54747
Veba B 31
Vestagon B 31
2-Imidazoline, 2-phenyl- (6CI, 7CI, 8CI)
4,5-Dihydro-2-phenyl-1H-imidazole (ACI)
Curezol 2PZ-L
Curezol 2PZL-T
Eutomer B 31
Jietongda SA 31
SA 31
物化性质
实验特性
LogP
0.80080
PSA
24.39000
折射率
1.5600 (estimate)
水溶性
溶解
沸点
181°C/20mmHg(lit.)
熔点
100.0 to 103.0 deg-C
闪点
华氏:303.8 °F 摄氏:151 °C
颜色与性状
白色结晶
溶解性
未确定
最大波长(λmax)
325(lit.)
密度
1,15 g/cm3
计算特性
精确分子量
146.08400
氢键供体数量
1
氢键受体数量
2
可旋转化学键数量
1
同位素质量
146.084
重原子数量
11
复杂度
157
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)
0.9
互变异构体数量
无
表面电荷
0
拓扑分子极性表面积
24.4A^2
海关数据
海关编码
2933290090
海关数据
中国海关编码:
2933290090
概述:
2933290090. 其他结构含非稠合咪唑环的化合物. 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:
2933290090. other compounds containing an unfused imidazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
相关文献
1.
Electrophilically activated nitroalkanes in reaction with aliphatic diamines en route to imidazolines
Alexander V. Aksenov,Nicolai A. Aksenov,Nikolai A. Arutiunov,Vladimir V. Malyuga,Sergey N. Ovcharov,Michael Rubin RSC Adv. 2019 9 39458
2.
Negative linear compression and expanding NH?N bonds in an imidazoline compound
Michalina Anio?a,Andrzej Katrusiak,Reza Kia CrystEngComm 2012 14 6424
3.
Cellulose solvent-based pretreatment for enhanced second-generation biofuel production: a review
Behzad Satari,Keikhosro Karimi,Rajeev Kumar Sustainable Energy Fuels 2019 3 11
4.
Efficient C2 functionalisation of 2H-2-imidazolines
Robin S. Bon,Nanda E. Sprenkels,Manoe M. Koningstein,Rob F. Schmitz,Frans J. J. de Kanter,Alexander D?mling,Marinus B. Groen,Romano V. A. Orru Org. Biomol. Chem. 2008 6 130
5.
Metal-free one-pot synthesis of 1,3-diazaheterocyclic compounds via I2-mediated oxidative C–N bond formation
Xianhai Tian,Lina Song,Ertong Li,Qiang Wang,Wenquan Yu,Junbiao Chang RSC Adv. 2015 5 62194
6.
Highly enantioselective synthesis of 5-phenyl-2-alkylprolines using phase-transfer catalytic alkylation
Myungmo Lee,Young-Ju Lee,Eunyoung Park,Yohan Park,Min Woo Ha,Suckchang Hong,Yeon-Ju Lee,Taek-Soo Kim,Mi-hyun Kim,Hyeung-geun Park Org. Biomol. Chem. 2013 11 2039
7.
Imidazolinium based porous hypercrosslinked ionic polymers for efficient CO2 capture and fixation with epoxides
Jing Li,Degong Jia,Zengjing Guo,Yangqing Liu,Yinong Lyu,Yu Zhou,Jun Wang Green Chem. 2017 19 2675
8.
74. 2-Amino-2-imidazolines and 2-amino-2-oxazolines. Part II
B. Adcock,Alexander Lawson J. Chem. Soc. 1965 474
9.
Building internal electric fields in porous ionic polymers for fast photocatalytic degradation of tetracycline hydrochloride
Shuaishuai Shang,Shenni Li,Changjun Peng,Honglai Liu,Jun Hu J. Mater. Chem. C 2023 11 7397
10.
Long-range metal–ligand bifunctional catalysis: cyclometallated iridium catalysts for the mild and rapid dehydrogenation of formic acid
Jonathan H. Barnard,Chao Wang,Neil G. Berry,Jianliang Xiao Chem. Sci. 2013 4 1234
参考资料
Reaxys RN
119250
Beilstein
23,154
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