1-氯-3-碘苯 | 625-99-0
中文名称:
1-氯-3-碘苯
英文名称:
3-Chloroiodobenzene
CAS No.:
625-99-0
分子式:
C6 H4 ClI
分子量:
238.4534
名称和标识符
MDL
MFCD00001046
InChIKey
JMLWXCJXOYDXRN-UHFFFAOYSA-N
Inchi
1S/C6H4ClI/c7-5-2-1-3-6(8)4-5/h1-4H
SMILES
IC1=C([H])C([H])=C([H])C(=C1[H])Cl
BRN
1904539
别名信息
- 中文别名 -
1-氯-3-碘苯
间氯碘苯
3-氯碘苯
1-氯-3-碘苯(含稳定剂铜屑)
1-Chloro-3-iodobenzene (stabilized with Copper chip) 1-氯-3-碘苯(含稳定剂铜屑)
- 英文别名 -
1-Chloro-3-iodobenzene
3-chloroiodobenzene
1-Chloro-3-iodobenzene (stabilized with Copper chip)
3-Chloro-1-iodobenzene
m-chloroiodobenzene
1-Chloro-3-iodo-benzene
1-iodo-3-chlorobenzene
3-Iodochlorobenzene
Benzene,1-chloro-3-iodo
m-Chlorophenyl iodide
metha-chloroiodobenzene
m-iodochlorobenzene
3-Chloroiodobenzene (stabilized with Copper chip)
Benzene, 1-chloro-3-iodo-
JMLWXCJXOYDXRN-UHFFFAOYSA-N
NSC32861
metachloroiodobenzene
3-iodo-chlorobenzene
3-chloro-iodobenzene
Chloro-3-iodobenzene
PubChem3647
2-Chloro-4-Iodobenzene
1-iodo-3-chloro-benzene
Benzene,1-chloro-3
3-Chloroiodobenzene
SY001074
625-99-0
W-104986
O10397
MFCD00001046
m-Chloroiodobenzene
NSC-32861
SCHEMBL139812
AI3-22030
m-chloro iodobenzene
1-chloranyl-3-iodanyl-benzene
A833875
EN300-131191
InChI=1/C6H4ClI/c7-5-2-1-3-6(8)4-5/h1-4
DS-14649
Z381540752
FT-0615488
NS00035089
AM61630
3-CHLOROIODOBENZENE
BP-20201
CS-W007365
A8651
EINECS 210-920-6
AKOS005254984
DTXSID4060810
3-Chloroiodobenzene, 98%
NSC 32861
物化性质
实验特性
LogP
2.94460
PSA
0.00000
折射率
n20/D 1.631(lit.)
水溶性
Soluble in water 67.2 mg/L.
沸点
228°C(lit.)
熔点
-9°C
闪点
华氏:215.6 °F 摄氏:102 °C
颜色与性状
无色液体。
溶解性
不溶于水。
敏感性
Light Sensitive
密度
1.926 g/mL at 25 °C(lit.)
计算特性
精确分子量
237.90500
氢键供体数量
0
氢键受体数量
0
可旋转化学键数量
0
同位素质量
237.905
重原子数量
8
复杂度
74.9
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)
3.6
互变异构体数量
无
表面电荷
0
拓扑分子极性表面积
0
海关数据
海关编码
2903999090
海关数据
中国海关编码:
2903999090
概述:
2903999090 其他芳烃卤化衍生物. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:5.5% 普通关税:30.0%
申报要素:
品名, 成分含量, 用途
Summary:
2903999090 halogenated derivatives of aromatic hydrocarbons VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%
相关文献
1.
Anion exchange membranes composed of perfluoroalkylene chains and ammonium-functionalized oligophenylenes
Hideaki Ono,Junpei Miyake,Shigehumi Shimada,Makoto Uchida,Kenji Miyatake J. Mater. Chem. A 2015 3 21779
2.
Towards a sustainable synthesis of amides: chemoselective palladium-catalysed aminocarbonylation of aryl iodides in deep eutectic solvents
Francesco Messa,Serena Perrone,Martina Capua,Francesco Tolomeo,Luigino Troisi,Vito Capriati,Antonio Salomone Chem. Commun. 2018 54 8100
3.
Palladium-mediated synthesis of [carbonyl-11C]amides and hydrazides using [11C]carbon monoxide
Farhad Karimi,Bengt L?ngstr?m J. Chem. Soc. Perkin Trans. 1 2002 2111
4.
Oxidation reduction reactions involving nitro groups in trifluoromethanesulfonic acid. Part 2. The reactions of chloromethylbenzenes with aromatic nitro Compounds
Rupert P. Austin,John H. Ridd J. Chem. Soc. Perkin Trans. 2 1994 1205
5.
Sequential Conia-ene-type cyclization and Negishi coupling by cooperative functions of B(C6F5)3, ZnI2, Pd(PPh3)4 and an amine
Min Cao,Ahmet Yesilcimen,Soumil Prasad,Jason Genova,Tanner Myers,Masayuki Wasa Org. Biomol. Chem. 2020 18 7090
6.
Quaternized poly(arylene perfluoroalkylene)s (QPAFs) for alkaline fuel cells – a perspective
Junpei Miyake,Kenji Miyatake Sustainable Energy Fuels 2019 3 1916
7.
Visible-light-induced cross-coupling of aryl iodides with hydrazones via an EDA-complex
Pan Pan,Shihan Liu,Yu Lan,Huiying Zeng,Chao-Jun Li Chem. Sci. 2022 13 7165
8.
A class of effective decarboxylative perfluoroalkylating reagents: [(phen)2Cu](O2CRF)
Yangjie Huang,Manjaly J. Ajitha,Kuo-Wei Huang,Zhongxing Zhang,Zhiqiang Weng Dalton Trans. 2016 45 8468
9.
Rotational barriers of biphenyls having heavy heteroatoms as ortho-substituents: experimental and theoretical determination of steric effects
Lodovico Lunazzi,Michele Mancinelli,Andrea Mazzanti,Susan Lepri,Renzo Ruzziconi,Manfred Schlosser Org. Biomol. Chem. 2012 10 1847
10.
Efficient photocatalytic chemoselective and stereoselective C–C bond formation over AuPd@N-rich carbon nitride
Heyan Jiang,Jie Xu,Sishi Zhang,Hongmei Cheng,Cuicui Zang,Fengxia Bian Catal. Sci. Technol. 2021 11 219
参考资料
Reaxys RN
1904539
Beilstein
5,220
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